CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

CFam Family Information

CFAM Family ID CFFID2065
Family Name Delta-type opioid receptor and Mu-type opioid receptor Ligand H-dmt-tic-nh-ch[(ch2)4-nh-ac]-bid Family
No. of Seeds 50 No. of Other Members 17
Family Centroid CFAMM00258588 Functional Category Investigative Drug with Natural Product
Superfamily Mu-type opioid receptor and Delta-type opioid receptor Binder Superfamily 3
Class Class 2341

Cousin Family NamesSeedsMembers
Leutinizing-hormone-releasing hormone inhibitor peptide Leupro... 43 911
Epidermal Growth Factor family 111 209
Insulin receptor Ligand Insulin, Porcine Family 61 205
Type-1 angiotensin II receptor Ligand Telmisartan Family 4 181
Gastrin/cholecystokinin type B receptor ligand oligopeptide Ce... 35 209
Somatostatin receptor type 2 ligand octapeptide Lanreotide Family 93 156
ostatin receptor 5 Ligand Pasireotide Diaspartate Family 11 151
Calcitonin gene-related peptide 1 Inhibitor Olcegepant Family 6 9
AEZS-108 family 5 2
Eluxadoline family 4 85
Cholecystokinin receptor type A Ligand A-71378 Family 77 23
Renin Inhibitor Enalkiren Family 56 44
Tyrosine kinase Inhibitor PKI166 Family 17 198
Renin Inhibitor Sul-pro-phe-n-mehis-lva-ile-amp Family 47 54
Glycogen synthase kinase-3 beta and Mitogen-activated protein ... 8 8
Delta-type opioid receptor and Gastrin/cholecystokinin type B ... 19 0
Melanocortin receptor Ligand Ac-his-dnal(2)-arg-trp-nh2 Family 112 67
Melanocortin receptor 3 and Melanocortin receptor 4 Ligand Ac-... 38 60
Tyrosine-protein kinase JAK2 and Tyrosine-protein kinase JAK3 ... 1 0
D(2) dopamine receptor and D(3) dopamine receptor Ligand D-366... 5 75
Type-1 angiotensin II receptor Ligand [sar1,tdf3]angii Family 135 2
Delta-type opioid receptor and Mu-type opioid receptor Ligand ... 18 72
Delta-type opioid receptor and Mu-type opioid receptor Ligand ... 13 15
Somatostatin receptor type 1 and Somatostatin receptor type 2 ... 46 0
Bombesin receptor subtype-3 and Gastrin-releasing peptide rece... 42 7
Pol polyprotein inhibitor penicillin deriv. 71 family 1 2
Pol polyprotein and Protease inhibitor 161186-52-3 family 3 3
Mu-type opioid receptor and Mu-type opioid receptor ligand Sur... 5 10
Adenosine receptor A1 and Adenosine receptor A2b ligand 3-meth... 7 19
Pol polyprotein inhibitor Hydroxyethylene deriv. 12 family 13 10
Integrin beta-3 and Integrin alpha-V inhibitor 2-[1-[2-[[4-(1H... 6 2
Pol polyprotein inhibitor (2S)-4-(1H-benzimidazol-2-ylmethyl)-... 1 0
Type-1A angiotensin II receptor and Type-1B angiotensin II rec... 2 9
Thyroid hormone receptor beta and Ferritin light chain ligand ... 1 35
Delta-type opioid receptor and Mu-type opioid receptor ligand ... 1 0
Pol polyprotein inhibitor N-[(3R,4R,5R)-5-[[(2S)-1-(1H-benzimi... 5 4
Pol polyprotein inhibitor propan-2-yl N-[(2S)-1-[[(2S,3S,5R)-3... 6 2
Type-1 angiotensin II receptor and Type-2 angiotensin II recep... 4 29
Glutamate receptor ionotropic, NMDA 2B and Glutamate receptor ... 4 11
Plasma kallikrein and Coagulation factor VII inhibitor 2-[(3E)... 15 49
Coagulation factor VII inhibitor 2-[(3E)-3-(5-carbamimidoyl-1,... 3 1
Platelet-derived growth factor receptor alpha and Vascular end... 3 1
Coagulation factor VII inhibitor [3-[(5E)-5-(5-carbamimidoyl-1... 3 2
Glutamate receptor ionotropic, NMDA 2B ligand 2-[[4-(4-chlorop... 4 1
Glutamate receptor ionotropic, NMDA 1 and Glutamate receptor i... 11 1
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subun... 2 0
Integrin beta-3 and Integrin alpha-V inhibitor 2-[1-[2-[[4-(1H... 2 8
Pol polyprotein and Protease inhibitor 161186-51-2 family 5 0
Integrin beta-3 and Integrin alpha-V inhibitor (2S)-3-[4-[4-[(... 9 7
Renin inhibitor (2R)-2-benzyl-N-[(2S)-1-[[(2S,3R,4S)-1-cyclohe... 6 0
Cationic trypsin and Prothrombin inhibitor 2-ketobenzothiazole... 1 3
5-hydroxytryptamine receptor 2B ligand SureCN1299002 family 2 8
Muscarinic acetylcholine receptor M3 and Muscarinic acetylchol... 2 0
Serine/threonine-protein kinase mTOR inhibitor 3-(cyclohexylme... 2 1


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00258600 CHEMBL563304 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-[(2S)-2-[[(2S)-1-[[(2S)-1-(1H-benzimidazol-2-yl)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258562 CHEMBL553461 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-3-hydroxy-1-oxopropan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258579 CHEMBL397357 Bioactive (3S)-N-[(5S)-5-acetamido-5-(1H-benzimidazol-2-yl)pentyl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258606 CHEMBL438681 Bioactive benzyl N-[(1S)-5-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-1-(1H-benzimidazol-2-yl)pentyl]carbamate
CFAMM00258593 CHEMBL1213939 Bioactive (3S)-3-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-(1H-benzimidazol-2-yl)propanoic acid
CFAMM00258552 CHEMBL232815 Bioactive (3S)-N-[(5S)-5-amino-5-(1H-benzimidazol-2-yl)pentyl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258585 CHEMBL354966 Bioactive 2-[2-[[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]methyl]benzimidazol-1-yl]acetic acid
CFAMM00258599 CHEMBL607403 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[2-(1H-benzimidazol-2-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258545 CHEMBL499099 Bioactive (3R)-3-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-(1-methylbenzimidazol-2-yl)propanoic acid
CFAMM00258615 CHEMBL557346 Bioactive [(2S)-2-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-(1H-benzimidazol-2-yl)-3-oxopropyl] acetate
CFAMM00258592 CHEMBL540724 Bioactive (4S)-4-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-5-(1H-benzimidazol-2-yl)-5-oxopentanoic acid
CFAMM00258551 CHEMBL538699 Bioactive (3S)-N-[(2S)-4-amino-1-(1H-benzimidazol-2-yl)-1,4-dioxobutan-2-yl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258598 CHEMBL553221 Bioactive (3S)-N-[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-6-amino-1-(1H-benzimidazol-2-yl)-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-(4-hydroxy-2,6-dimethylphenyl)-1-oxopropan-2-yl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258544 CHEMBL1213988 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-(1H-benzimidazol-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258614 CHEMBL556230 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[2-(1H-benzimidazol-2-yl)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258558 CHEMBL607479 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258591 CHEMBL540972 Bioactive (3S)-3-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-4-(1H-benzimidazol-2-yl)-4-oxobutanoic acid
CFAMM00258604 CHEMBL607480 Bioactive 2-[[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]methyl]benzimidazole-1-carboxylic acid
CFAMM00258550 CHEMBL564083 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-5-[[amino(nitramido)methylidene]amino]-1-(1H-benzimidazol-2-yl)-1-oxopentan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258583 CHEMBL2375157 Bioactive (3S)-N-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxoethyl]-2-[(2R)-3-(4-hydroxy-2,6-dimethylphenyl)-2-methylpropyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258597 CHEMBL322300 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[[1-(2-amino-2-oxoethyl)benzimidazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258613 CHEMBL559088 Bioactive benzyl N-[(5S)-5-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-6-(1H-benzimidazol-2-yl)-6-oxohexyl]carbamate
CFAMM00258543 CHEMBL606737 Bioactive (2S)-2-amino-1-[(3S)-3-(1H-benzimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(4-hydroxy-2,6-dimethylphenyl)propan-1-one
CFAMM00258603 CHEMBL173884 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[[1-(cyclopropylmethyl)benzimidazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258596 CHEMBL554838 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258541 CHEMBL539386 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-4-methyl-1-oxopentan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258555 CHEMBL422547 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(1-methylbenzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258610 CHEMBL606603 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258589 CHEMBL354392 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(1-prop-2-enylbenzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258602 CHEMBL197183 Bioactive ethyl 2-[2-[[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]methyl]benzimidazol-1-yl]acetate
CFAMM00258548 CHEMBL1213987 Bioactive (3S)-2-[(2S)-2-amino-3-(2,6-difluoro-4-hydroxyphenyl)propanoyl]-N-(1H-benzimidazol-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258564 CHEMBL538457 Bioactive (3S)-N-[(2S)-6-acetamido-1-(1H-benzimidazol-2-yl)-1-oxohexan-2-yl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258595 CHEMBL556063 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-1-oxo-3-phenylpropan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258601 CHEMBL607401 Bioactive (2S)-2-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-(1H-benzimidazol-2-yl)propanoic acid
CFAMM00258547 CHEMBL554625 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-1-oxo-3-phenylpropan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258563 CHEMBL538456 Bioactive (3S)-N-[(2S)-6-amino-1-(1H-benzimidazol-2-yl)-1-oxohexan-2-yl]-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258594 CHEMBL1213938 Bioactive (3S)-3-[[(3S)-2-[(2S)-2-amino-3-(2,6-difluoro-4-hydroxyphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]amino]-3-(1H-benzimidazol-2-yl)propanoic acid
CFAMM00258553 CHEMBL436063 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(1-benzylbenzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258569 CHEMBL551937 Bioactive (3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-[(2S)-1-(1H-benzimidazol-2-yl)-1-oxopropan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CFAMM00258587 CHEMBL208461 Bioactive (2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-1-[(3S)-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one
CFAMM00258568 DNC013110 Investigative Drug H-Dmt-Tic-NH-CH[(CH2)4-NH2]-Bid
CFAMM00258559 DNC013683 Investigative Drug H-Dmt-Tic-NH-(R)CH(CH2-COOH)-Bid
CFAMM00258605 DNC013684 Investigative Drug H-Dmt-Tic-NH-(R)CH(CH2-COOH)-Bid(N1-Me)
CFAMM00258567 DNC013113 Investigative Drug H-Dmt-Tic-NH-CH[(CH2)4-NH-Z]-Bid
CFAMM00258584 DNC006751 Investigative Drug H-Dmt-Tic-Gly-NH-CH2-Bid
CFAMM00258566 DNC013112 Investigative Drug H-Dmt-Tic-NH-(D)-CH[(CH2)4-NH-Z]-Bid
CFAMM00258565 DNC011527 Investigative Drug UFP-502
CFAMM00258572 DNC006747 Investigative Drug H-Dmt-Aba-Gly-NH-CH2-Bid
CFAMM00258581 DNC012657 Investigative Drug UFP-512
CFAMM00258588 DNC013111 Investigative Drug H-Dmt-Tic-NH-CH[(CH2)4-NH-Ac]-Bid

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

26413 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543