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 CFFBM3900
Family Name Multidrug resistance protein 1 inhibitor 1-[2-[(2R)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one family
No. of Seeds 2 No. of Other Members 41
Family Centroid CFAMM00351553 Functional Category Bioactive
Superfamily Multidrug resistance protein 1 Binder Superfamily
Class Class 1685

Cousin Family NamesSeedsMembers
Beta adrenergic receptor Ligand Levobunolol Family 6 133
Beta-1 adrenergic receptor Ligand Acebutolol Family 2 27
Sodium channel protein type 5 subunit alpha Ligand Dyclonine F... 6 174
Sodium channel protein type 5 subunit alpha Ligand Flecainide ... 2 162
Acetylcholinesterase Inhibitor Donepezil Family 23 242
HIV-1 protease Inhibitor Lopinavir Family 4 25
Muscarinic acetylcholine receptor Ligand Flavoxate Family 9 350
Beta-2 adrenergic receptor Ligand Salmeterol Xinafoate Family 9 51
C-C chemokine receptor type 5 Ligand GW873140 Family 6 78
5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Lig... 2 23
Cytochrome P450 2D6 and Delta-type opioid receptor Ligand 4-(s... 17 381
5-hydroxytryptamine receptor 1A Ligand (s)-way 100135 Family 94 975
Alpha-2C adrenergic receptor Ligand ARC239 Family 15 23
5-hydroxytryptamine receptor 1A Ligand NAN-190 Family 14 28
Voltage-dependent L-type calcium channel Ligand PD173212 Family 24 104
Plasmepsin-2 Inhibitor PS-662477 Family 7 55
Potassium voltage-gated channel subfamily A member 3 Ligand 2-... 9 92
Oxytocin receptor and Vasopressin V1a receptor Ligand L-371257... 8 92
5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Lig... 7 22
5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Lig... 2 14
Histamine H3 receptor Ligand A-349821 Family 49 228
Alpha-1A adrenergic receptor Ligand Upidosin Family 8 46
Alpha-1A adrenergic receptor Ligand Naftopidil Family 15 119
Acetylcholinesterase and Cholinesterase Inhibitor 3-[7-(benzyl... 22 303
Melanin-concentrating hormone receptor 1 Ligand N-(1-benzylpip... 9 57
Amyloid beta A4 protein Inhibitor 6-iodo-4'-methylaminoflavone... 3 33
Beta-2 adrenergic receptor Ligand Gnf-pf-1694 Family 4 70
Galanin receptor type 1 and Galanin receptor type 2 Ligand Gal... 55 132
Kappa-type opioid receptor Ligand 3-(1-benzylpiperidin-4-yloxy... 24 54
Reverse transcriptase Inhibitor 10-propyl-10h-dibenzo[b,f][1,4... 9 60
D(2) dopamine receptor Ligand Epidepride Family 31 66
Potassium voltage-gated channel subfamily KQT member 1 Ligand ... 5 17
Acetylcholinesterase Inhibitor 6-methyl-4-(4-benzoylpiperazin-... 2 6
Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-n-... 24 73
Alpha-1B adrenergic receptor and Alpha-1D adrenergic receptor ... 4 10
5-hydroxytryptamine receptor 1A and Sodium-dependent serotonin... 1 8
Beta-2 adrenergic receptor and Beta-1 adrenergic receptor liga... 3 6
Beta-1 adrenergic receptor ligand 4-[2-[[(2S)-3-(2-cyano-5-flu... 3 2
Alpha-2B adrenergic receptor and Alpha-2C adrenergic receptor ... 3 2
Sigma non-opioid intracellular receptor 1 and 5-hydroxytryptam... 20 9
Alpha-1A adrenergic receptor and Alpha-1D adrenergic receptor ... 3 2
Histamine H3 receptor and Potassium voltage-gated channel subf... 3 4
Sigma non-opioid intracellular receptor 1 and Vesicular acetyl... 3 7
Kappa-type opioid receptor and Cytochrome P450 2D6 ligand Sure... 4 3
C-C chemokine receptor type 1 and Chemokine (C-C motif) recept... 11 15
C-C chemokine receptor type 1 and Chemokine (C-C motif) recept... 1 16
C-C chemokine receptor type 1 ligand [2-[(2S)-3-(5-chlorospiro... 3 0
C-C chemokine receptor type 1 ligand 2-[(2S)-3-(5-chlorospiro[... 2 3
Alpha-1A adrenergic receptor and Alpha-1B adrenergic receptor ... 1 5
Beta-3 adrenergic receptor and Beta-1 adrenergic receptor liga... 14 1
5-hydroxytryptamine receptor 3A and 5-hydroxytryptamine recept... 7 1
Capsid scaffolding protein inhibitor AC1MHP1L family 3 6
Pol polyprotein inhibitor (3S)-N-tert-butyl-2-[(2R)-2-[(3S,6S,... 3 1
5-hydroxytryptamine receptor 2A and 5-hydroxytryptamine recept... 1 2
Growth hormone secretagogue receptor type 1 ligand SureCN76477... 2 1
Beta-secretase 1 inhibitor 1-N-[(2S,3R)-1-(3,5-difluorophenyl)... 8 7
Acetylcholinesterase and Cholinesterase inhibitor AGN-PC-04X9O... 2 1
Beta-3 adrenergic receptor ligand 4-[4-[2-[[(2R)-2-(4-aminophe... 3 0
5-hydroxytryptamine receptor 2A and 5-hydroxytryptamine recept... 3 2
Renin inhibitor (2S,4S,5S,7S)-5-amino-4-hydroxy-7-[[4-methoxy-... 2 0
Muscarinic acetylcholine receptor M1 and Muscarinic acetylchol... 4 0
5-hydroxytryptamine receptor 1A and D(2) dopamine receptor lig... 1 0
Histamine H1 receptor and Cysteinyl leukotriene receptor 1 lig... 1 15
Alpha-1D adrenergic receptor and Alpha-1A adrenergic receptor ... 2 9
Sodium- and chloride-dependent glycine transporter 1 inhibitor... 2 1
Sigma non-opioid intracellular receptor 1 and D(2) dopamine re... 2 3
Peroxisome proliferator-activated receptor gamma and Peroxisom... 3 1
Estrogen receptor and Estrogen receptor beta ligand (3Z)-3-[[2... 3 0
Multidrug resistance protein 1 inhibitor (1R)-2-[4-(2-methoxyp... 2 0


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00351553 CHEMBL2449435 Bioactive 1-[2-[(2R)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one
CFAMM00351532 CHEMBL375243 Bioactive 1-[2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one

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
 

 

45558 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