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 CFFID594
Family Name Equilibrative nucleoside/nucleobase transporter Inhibitor Nitrobenzylthioinosine Family
No. of Seeds 23 No. of Other Members 98
Family Centroid CFAMM00214452 Functional Category Investigative Drug with Natural Product
Superfamily Equilibrative nucleoside/nucleobase transporter Inhibitor Nitrobenzylthioinosine Superfamily
Class Class 652

Cousin Family NamesSeedsMembers
Cyclin-dependent kinase 2 Inhibitor Seliciclib Family 29 292
P2Y purinoceptor 12 Inhibitor Brilinta Family 1 1
Adenosine receptor A3 Ligand CF101 Family 24 560
Adenosine receptor A2a Ligand MRE-0094 Family 10 108
C-Jun N-terminal kinase Inhibitor CC-930 Family 2 9
Poly [ADP-ribose] polymerase 1 Inhibitor EB-47 Family 17 41
Amine oxidase [flavin-containing] A and Amine oxidase [flavin-... 2 7
Adenosine receptor A1 and Adenosine receptor A2a Ligand N6-met... 7 72
Mitogen-activated protein kinase 14 Inhibitor 9-benzyl-6-pheny... 5 33
Adenosine receptor A1 and Adenosine receptor A2a Ligand GW-328... 26 94
Adenosine receptor A1 and Adenosine receptor A2a Ligand N6-met... 21 57
Adenosine receptor A1 and Adenosine receptor A2a Ligand 2-[(4-... 15 9
Adenosine receptor A1 and Adenosine receptor A2a Ligand 2-(3''... 12 5
Adenosine receptor A1 and Adenosine receptor A2a Ligand 2-(3''... 2 2
Adenosine receptor A2a and Adenosine receptor A3 Ligand 2-(3''... 8 10
Inositol 1,4,5-trisphosphate receptor type 3 Ligand 5'-deoxy-5... 11 8
Adenosine kinase inhibitor GP683 family 12 7
Adenosine receptor A3 and Adenosine receptor A1 ligand (2R,3S,... 1 2
Adenosine receptor A1 and Adenosine receptor A2a ligand (2S,3S... 2 16
5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase inh... 7 6
Adenosine receptor A3 and Adenosine receptor A2a ligand (1R,2R... 12 17
Adenosine kinase inhibitor N-cyclopropyl-2-[[1-[(2R,3R,4S,5R)-... 4 1
Adenosine receptor A1 ligand N-[(2R,3R,4R,5R)-5-[6-(cyclopenty... 3 2
Adenosine kinase inhibitor 2-[[7-[(2R,3R,4S,5R)-3,4-dihydroxy-... 15 0
Adenosine kinase inhibitor SureCN8320660 family 7 2
Adenosine receptor A3 and Adenosine receptor A1 ligand (2S,3S,... 8 10
Adenosine receptor A3 ligand (1R,2R,3S,4R,5S)-4-[2-[2-(2-chlor... 5 1
Adenosine receptor A1 and Adenosine receptor A2a ligand (2R,3R... 1 2
Adenosine receptor A3 ligand (2R,3R,4S)-2-[2-chloro-6-[(3-fluo... 6 7
Adenosine receptor A3 ligand (2R,3R,4S)-2-[6-[(3-bromophenyl)m... 3 0
Adenosine receptor A1 and Adenosine receptor A3 ligand N-benzy... 4 2
Adenosine receptor A1 ligand 2-[4-[[2-[4-[[9-[(3R,4S,5R)-3,4-d... 14 0
Adenosine receptor A1 ligand 3-chloro-N-[(2S,3R,4R,5R)-5-[6-(c... 1 0
Adenosine receptor A1 ligand N-[(2R,3R,4R,5R)-5-[6-(cyclopenty... 3 3
Adenosine receptor A2a and Adenosine receptor A2b ligand Cgs-2... 1 2
Adenosine receptor A1 ligand (2,5-dioxopyrrolidin-1-yl) 2-[4-[... 3 0
Adenosine receptor A1 ligand (2-bromophenyl)methyl (1S,3R,4S)-... 1 0
Equilibrative nucleoside transporter 1 inhibitor N-[6-[2-[[(2S... 2 0
Adenosine receptor A2a and Adenosine receptor A3 ligand SureCN... 4 3
Adenosine receptor A2a and Adenosine receptor A2b ligand (3S,4... 3 2
Adenosine receptor A2a and Adenosine receptor A2b ligand (3R,4... 7 3
P2Y purinoceptor 12 inhibitor [(3aR,4R,6R,6aR)-4-[6-(ethylcarb... 2 4
78 kDa glucose-regulated protein and Heat shock cognate 71 kDa... 1 0


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00214454 CHEMBL610234 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(cyclopentylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214418 CHEMBL607955 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(cyclopropylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214513 CHEMBL610942 Bioactive SureCN7617534
CFAMM00214398 CHEMBL611841 Bioactive (3R,4S,5R)-2-[6-[(4-fluorophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214490 CHEMBL61915 Bioactive 4-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]sulfanylmethyl]benzonitrile
CFAMM00214453 CHEMBL610235 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(hexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214497 CHEMBL239246 Bioactive (2R,3R,4S,5R)-2-[2-fluoro-6-[(4-nitrophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214423 CHEMBL418496 Bioactive (2R,3R,4S,5R)-2-[6-[(4-fluorophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214510 CHEMBL394171 Bioactive NBTGR
CFAMM00214409 CHEMBL512162 Bioactive (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[(4-iodophenyl)methylsulfanyl]purin-9-yl]oxolane-3,4-diol
CFAMM00214488 CHEMBL608794 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(butylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214415 CHEMBL608592 Bioactive (3R,4S,5R)-2-[6-[(4-bromophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214487 CHEMBL608795 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214413 CHEMBL609378 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(propylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214507 CHEMBL61773 Bioactive (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[(3-nitrophenyl)methylsulfanyl]purin-9-yl]oxolane-3,4-diol
CFAMM00214455 CHEMBL610236 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(2-methylbutylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214514 CHEMBL610941 Bioactive (2R,3S,4R)-2-(hydroxymethyl)-5-[6-[(4-iodophenyl)methylsulfanyl]purin-9-yl]oxolane-3,4-diol
CFAMM00214399 CHEMBL610047 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(pentylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214412 CHEMBL609377 Bioactive (3R,4S,5R)-2-[6-benzylsulfanyl-8-(ethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CFAMM00214475 DNC008046 Investigative Drug S6-nitrobenzyl mercaptopurine riboside
CFAMM00214452 DNC001624 Investigative Drug Nitrobenzylthioinosine
CFAMM00214407 DNC014336 Investigative Drug 6-Benzylthioinosine

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
 

 

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Dr. Chen Yuzong

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


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