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 CFFAD514
Family Name HIV-1 protease Inhibitor Atazanavir Family
No. of Seeds 16 No. of Other Members 58
Family Centroid CFAMM00071678 Functional Category Approved Drug
Superfamily HIV-1 protease Inhibitor Atazanavir Superfamily
Class Class 137

Cousin Family NamesSeedsMembers
HIV protease Inhibitor Indinavir Family 36 211
HIV protease Inhibitor Saquinavir Family 64 428
Gastrin/cholecystokinin type B receptor ligand peptide Pentaga... 26 1171
Somatostatin receptor type 2 ligand octapeptide Octreotide Family 27 172
Sodium channel protein type 5 subunit alpha Ligand Disopyramid... 4 352
Gastrin/cholecystokinin type B receptor ligand oligopeptide Ce... 35 209
Indoleamine 2,3-dioxygenase 1 Inhibitor L-tryptophan Family 8 328
Bacterial outer membrane Inhibitor Daptomycin Family 6 50
Somatostatin receptor type 2 ligand octapeptide Lanreotide Family 93 156
ostatin receptor 5 Ligand Pasireotide Diaspartate Family 11 151
5-hydroxytryptamine receptor Ligand Metergolin Family 2 11
Histone deacetylase 1 Inhibitor MS-275 Family 4 41
Substance-P receptor Ligand GSK424887 Family 8 184
Coagulation factor X Inhibitor Otamixaban Family 9 21
Gamma-aminobutyric acid receptor Ligand E-2007 Family 7 118
CBP-501 family 7 8
CP-18770 family 6 27
Cholecystokinin receptor type A Ligand A-71378 Family 77 23
Gastrin/cholecystokinin type B receptor Ligand PD136450 Family 53 117
Lethal factor Inhibitor GM6001 Family 50 435
FK506-binding protein 1A Inhibitor Gpi-1046 Family 4 10
Substance-K receptor and Substance-P receptor Ligand L-732138 ... 8 147
Integrin beta-3 Inhibitor Elarofiban Family 28 45
Cathepsin B and Cathepsin K Inhibitor Z-arg-leu-val-agly-ile-v... 3 19
Renin Inhibitor Sul-pro-phe-n-mehis-lva-ile-amp Family 47 54
cGMP-inhibited 3',5'-cyclic phosphodiesterase A and Cytochrome... 9 40
Cathepsin K and Cathepsin S Inhibitor P2,p3 Ketoamide Derivati... 2 1
Delta-type opioid receptor and Gastrin/cholecystokinin type B ... 19 0
Cholecystokinin receptor type A Ligand VL-0395 Family 12 117
Delta-type opioid receptor Ligand H-poa-ser-gly-phe-leu-thr-oh... 5 12
Cannabinoid receptor 1 Ligand N-phenyl-5,6-dip-tolylpyrazine-2... 11 26
Angiotensin-converting enzyme and Endothelin-converting enzyme... 2 10
Endothelin B receptor Ligand IRL-2500 Family 34 87
Vasopressin V1a receptor and Vasopressin V1b receptor Ligand D... 10 19
Delta-type opioid receptor and Mu-type opioid receptor Ligand ... 18 72
Somatostatin receptor type 1 and Somatostatin receptor type 2 ... 46 0
Renin inhibitor (2S,4S,5S)-6-cyclohexyl-4-hydroxy-5-[[(2S)-2-[... 3 0
Pol polyprotein inhibitor AC1LAD48 family 19 5
C-C chemokine receptor type 5 ligand AC1LAJEM family 4 14
Pol polyprotein inhibitor pyridin-2-ylmethyl N-[(2R)-1-[[(2S,3... 15 8
Cathepsin K and Cathepsin S inhibitor dipeptidyl nitrile, 16f ... 3 18
Pol polyprotein inhibitor Hydroxyethylene deriv. 12 family 13 10
Plasmepsin-1 and Plasmepsin-2 inhibitor Statine-like inhibitor... 13 5
Neutrophil elastase inhibitor SureCN7284457 family 4 6
Pol polyprotein inhibitor N-[(2S)-1-[[(2S,3R,4S,5S)-3,4-dihydr... 2 0
Pol polyprotein inhibitor N-[3-[[(4R,5R,6R)-4-benzyl-5-hydroxy... 1 0
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 14 8
Neutrophil collagenase and Stromelysin-3 inhibitor AC1MORIH fa... 7 9
Growth hormone secretagogue receptor type 1 ligand 2-amino-N-[... 3 0
Pol polyprotein inhibitor Carbamic acid, ((2-hydroxy-1,4-bis(p... 21 1
Renin and Pepsin A inhibitor [(2S)-1-[[(2R)-1-[[(2S,3R)-1-cycl... 2 2
Cathepsin L1 and Cathepsin K inhibitor benzyl N-[(2S)-1-oxo-3-... 1 1
Pol polyprotein inhibitor AC1LAMRC family 3 0
Calpain-2 catalytic subunit and Calpain-1 catalytic subunit in... 8 8
Pol polyprotein inhibitor BEJ family 2 0
Renin inhibitor [(2S,4S,5S,7R)-4-amino-8-(butylamino)-5-hydrox... 3 1
Pol polyprotein and Protease inhibitor Palinavir family 1 0
Calpain-1 catalytic subunit and Cathepsin B inhibitor AGN-PC-0... 5 2
Somatostatin receptor type 2 ligand tert-butyl (2S)-6-amino-2-... 1 2
Cholecystokinin receptor type A and Gastrin/cholecystokinin ty... 4 53
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 2 0
Growth hormone-releasing hormone receptor ligand ethyl (1S)-1'... 3 2
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 3 0
Peptide deformylase inhibitor (2R)-N-[(2S)-3,3-dimethyl-1-oxo-... 2 1
Pol polyprotein and Cathepsin D inhibitor N-[(1S)-1-[(2R,3S)-3... 2 1
Cruzipain and Cathepsin L1 inhibitor pyridin-3-ylmethyl N-[(2S... 7 4
Protein farnesyltransferase/geranylgeranyltransferase type-1 s... 6 4
C-C chemokine receptor type 1 ligand N-[(2S,3S,5R)-5-carbamoyl... 10 4
Pol polyprotein inhibitor (2S,4S,5S)-5-acetamido-6-cyclohexyl-... 3 3
Bifunctional epoxide hydrolase 2 inhibitor AGN-PC-04SK7R family 3 3
Substance-K receptor ligand N-[1-[[(2R)-5-[4-(oxan-4-ylmethyl)... 2 0
Interstitial collagenase and Matrilysin inhibitor (2S,3R)-N,2-... 3 1
Renin inhibitor (3R)-4-[[(2S,5S)-1-cyclohexyl-3-hydroxy-6-meth... 3 4
Pol polyprotein inhibitor (2R,3R,4R,5S)-5-[[(2S)-2-[5-[(4R,6aS... 1 0
Smoothened homolog inhibitor (8aS)-N-[2-(3-cyanophenyl)pyridin... 3 4
Integrin beta-3 and Integrin alpha-V inhibitor (2S)-3-[5-methy... 4 5
Integrin beta-3 and Integrin alpha-V inhibitor AGN-PC-075FXA f... 1 0
Beta-secretase 1 inhibitor (2S)-2-[(3S)-3-acetamido-3-butan-2-... 4 4
Metabotropic glutamate receptor 5 ligand AGN-PC-075X3Y family 2 6
Caspase-1 and Caspase-8 inhibitor (4S,7S,11aS)-2-(benzenesulfo... 3 0
Orexin receptor type 1 and Orexin receptor type 2 ligand N-[[(... 1 0
Pol polyprotein inhibitor AC1LAHQ9 family 8 15
Prothrombin and Tissue-type plasminogen activator inhibitor 2-... 4 5
Cathepsin K and Cathepsin S inhibitor dipeptidyl nitrile, 16b ... 2 0
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 3 0
Pol polyprotein inhibitor AC1LAHRX family 4 0
Renin inhibitor tert-butyl N-[1-[[1-[[(2S,3S)-1-cyclohexyl-3-h... 1 0
Pancreatic alpha-amylase and Gastrin/cholecystokinin type B re... 7 1
Probable G-protein coupled receptor 142 ligand (2S)-N-(2-oxo-5... 2 1
Renin inhibitor (E)-but-2-enedioic acid;(3S,5R)-5-[4-(2-chloro... 6 8
Beta-secretase 1 and Cathepsin B inhibitor SureCN14347937 family 4 1
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 2 4
Renin inhibitor (2S,4S,5S)-5-amino-6-[4-(2-chlorophenyl)-2,2-d... 3 0
Integrin beta-3 and Integrin alpha-IIb inhibitor SureCN7013744... 2 3
Metabotropic glutamate receptor 5 ligand AGN-PC-09SALK family 2 15
Neprilysin and Angiotensin-converting enzyme inhibitor (2S)-2-... 1 4
Pol polyprotein inhibitor 183854-98-0 family 15 2
Pol polyprotein inhibitor Cyclic Urea 68 family 4 0
Renin inhibitor tert-butyl N-[1-[[1-[[1-cyclohexyl-4,4-difluor... 5 0
Pol polyprotein inhibitor AC1LALGZ family 2 14
Stromelysin-1 and 72 kDa type IV collagenase inhibitor (2S,4R)... 2 2
Pol polyprotein inhibitor Palinavir deriv. 13 family 1 0
Neutrophil collagenase and Stromelysin-3 inhibitor [3-[[1-amin... 3 2
Pol polyprotein inhibitor 183854-15-1 family 3 0
Renin and Cathepsin D inhibitor (4S)-5-cyclohexyl-2,2-difluoro... 4 1
Substance-P receptor ligand (4R)-N-[(2R)-1-[benzyl(methyl)amin... 8 5
Pol polyprotein inhibitor [(2R,3R)-1,1-dioxo-2-propan-2-ylthio... 11 0
Renin inhibitor tert-butyl N-[1-[[1-[[(3R,4S)-1-cyclohexyl-3,4... 2 2
Platelet-activating factor receptor ligand SureCN9853140 family 3 3
Gonadotropin-releasing hormone receptor ligand methyl 4-[2-[[(... 2 1
Pol polyprotein inhibitor AC1LAMQU family 2 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[(1-benz... 2 1
Neprilysin and Angiotensin-converting enzyme inhibitor (2S)-2-... 2 3
Alpha-2A adrenergic receptor and Alpha-2B adrenergic receptor ... 9 3
Beta-secretase 1 and Cathepsin B inhibitor SureCN14347784 family 4 0
Angiotensin-converting enzyme inhibitor AC1L1IZN family 2 2
CGMP-dependent protein kinase inhibitor AGN-PC-0761UG family 1 2
P2Y purinoceptor 12 inhibitor (4S)-4-[[4-[4-[3-(dimethylamino)... 106 49
Pol polyprotein inhibitor 173094-24-1 family 1 0
Beta-secretase 1 and Cathepsin D inhibitor N-[(2S,3R)-4-[[6-(3... 3 1
Rho-associated protein kinase 2 and Rho-associated protein kin... 1 0
Probable G-protein coupled receptor 142 ligand (2S)-2-[[(2R)-o... 1 0
Thromboxane A2 receptor ligand SureCN8058805 family 2 1
Pol polyprotein inhibitor AC1LA6OV family 1 2
Pol polyprotein inhibitor tert-butyl N-[(2S,3R)-3-hydroxy-4-[[... 1 1
Putative NP ZINC03999154 Family 4 0


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00071678 DAP000706 Approved Drug Atazanavir
CFAMM00071671 CHEMBL113626 Bioactive (2S)-N-[(2S,4S)-3-hydroxy-4-[[(2R)-3-methyl-2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanoyl]amino]-1,5-diphenylpentan-2-yl]-3-methyl-2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butanamide
CFAMM00071658 CHEMBL380970 Bioactive SureCN3528760
CFAMM00071686 CHEMBL436952 Bioactive SureCN3948560
CFAMM00071707 CHEMBL381326 Bioactive SureCN3526822
CFAMM00071656 CHEMBL206467 Bioactive SureCN3946170
CFAMM00071706 CHEMBL380522 Bioactive SureCN3525939
CFAMM00071684 CHEMBL77281 Bioactive AC1NUI2B
CFAMM00071691 CHEMBL112546 Bioactive pyridin-4-ylmethyl N-[(2S)-1-[[(2S,3S,4S)-3-hydroxy-4-[[(2R)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-1,5-diphenylpentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CFAMM00071654 CHEMBL114192 Bioactive (2R)-N-[(2S,4S)-3-hydroxy-4-[[(2S)-3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)butanoyl]amino]-1,5-diphenylpentan-2-yl]-3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)butanamide
CFAMM00071673 CHEMBL94991 Bioactive tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(2S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]amino]-6-oxo-1-phenylhexan-2-yl]carbamate
CFAMM00071689 CHEMBL109371 Bioactive pyridin-2-ylmethyl N-[(2S)-1-[[(2S,3S,4S)-3-hydroxy-4-[[(2R)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-1,5-diphenylpentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CFAMM00071703 CHEMBL327565 Bioactive AC1L9R18
CFAMM00071702 CHEMBL327564 Bioactive AC1L9R19
CFAMM00071651 CHEMBL113451 Bioactive (2S)-N-[(2S,3R,4S,5S)-3,4-dihydroxy-5-[[(2R)-3-methyl-2-[[(E)-3-pyridin-2-ylprop-2-enoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[[(E)-3-pyridin-2-ylprop-2-enoyl]amino]butanamide
CFAMM00071680 CHEMBL106486 Bioactive pyridin-2-ylmethyl N-[(2R)-1-[[(2S,4S)-3-hydroxy-4-[[(2S)-3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-1,5-diphenylpentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate

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
 

 

42885 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