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 CFFID2877
Family Name Integrin beta-1 and Integrin alpha-4 Inhibitor MK-0668 Family
No. of Seeds 46 No. of Other Members 20
Family Centroid CFAMM00278353 Functional Category Investigative Drug
Superfamily Integrin beta-1 and Integrin alpha-4 Inhibitor MK-0668 Superfamily
Class Class 2592

Cousin Family NamesSeedsMembers
Thromboxane-A synthase Inhibitor CGS-22652 Family 37 95
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-[(3,5... 28 18
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-[(2,6... 3 14
Integrin beta-1 and Integrin alpha-4 inhibitor (Z)-2-[[(4S)-3-... 2 1
Pol polyprotein inhibitor AC1LAHQ9 family 8 15
Integrin beta-1 and Integrin alpha-4 inhibitor 3,5-dichloro-N-... 1 1
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-[(2-c... 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[(2S)-1... 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[2-[car... 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-[(3,5... 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor SureCN6374908 f... 3 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[(1-benz... 2 1
Integrin beta-1 and Integrin alpha-4 inhibitor SureCN5370042 f... 8 0
Integrin beta-1 and Integrin alpha-4 inhibitor SureCN5367895 f... 3 0
Integrin beta-1 and Integrin alpha-4 inhibitor SureCN6367793 f... 2 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-[(2,6... 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[(2S)-1... 3 0


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00278395 CHEMBL567433 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(3-fluoropiperidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278348 CHEMBL505992 Bioactive (2S)-2-[[(2S,4R)-1-(3,5-dichlorophenyl)sulfonyl-4-pyrrolidin-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278375 CHEMBL1160252 Bioactive (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-[4-[(3-methylsulfanylpyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278354 CHEMBL506449 Bioactive SureCN5200719
CFAMM00278381 CHEMBL569263 Bioactive SureCN4398074
CFAMM00278394 CHEMBL601467 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-pyrazol-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278374 CHEMBL502641 Bioactive (2S)-2-[[(2S,4R)-4-(azetidin-1-yl)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278400 CHEMBL565499 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(4-fluoropiperidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278340 CHEMBL589749 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-morpholin-4-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278380 CHEMBL589558 Bioactive AGN-PC-07R98U
CFAMM00278393 CHEMBL601469 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(1,2,4-triazol-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278360 CHEMBL294708 Bioactive (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-[4-[(2,4-dichloropyridine-3-carbonyl)amino]phenyl]propanoic acid
CFAMM00278373 CHEMBL569302 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-[(3S)-3-fluoropyrrolidin-1-yl]pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278386 CHEMBL601682 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(4,5,6,7-tetrahydroindazol-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278399 CHEMBL59531 Bioactive (2S)-2-[[(2S)-1-(benzenesulfonyl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278339 CHEMBL589748 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-indazol-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278379 CHEMBL569403 Bioactive (2S)-2-[[(2S,4R)-4-(azetidin-1-yl)-1-(3-cyanophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278392 CHEMBL601468 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-imidazol-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278366 CHEMBL444822 Bioactive (2S)-2-[[(2S,4S)-4-(azetidin-1-yl)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278345 CHEMBL569255 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-pyrrolidin-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278372 CHEMBL569442 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-[cyclobutyl(2,2,2-trifluoroethyl)amino]pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278385 CHEMBL601685 Bioactive (2S)-2-[[(2S,4R)-4-(azocan-1-yl)-1-(3-cyanophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278398 CHEMBL330525 Bioactive (2S)-3-[4-(3-cyanopyridin-2-yl)phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
CFAMM00278351 CHEMBL296804 Bioactive SureCN5201410
CFAMM00278378 CHEMBL569407 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(3,3-difluoroazetidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278391 CHEMBL601686 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-thiomorpholin-4-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278404 CHEMBL53733 Bioactive (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-[4-(pyridine-3-carbonylamino)phenyl]propanoic acid
CFAMM00278371 CHEMBL569443 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(3,3-difluoropyrrolidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278384 CHEMBL507665 Bioactive (2S)-2-[[(2S,4R)-4-amino-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278397 CHEMBL298835 Bioactive (2S)-2-[[(2S)-1-(3-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278364 CHEMBL569444 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(4,4-difluoropiperidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278377 CHEMBL55900 Bioactive (2S)-3-[4-[(3-chloro-1-methylpyridin-1-ium-4-carbonyl)amino]phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
CFAMM00278390 CHEMBL601688 Bioactive AGN-PC-07R98S
CFAMM00278343 CHEMBL569276 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-[(3R)-3-fluoropyrrolidin-1-yl]pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278403 CHEMBL601896 Bioactive SureCN4393458
CFAMM00278356 CHEMBL566154 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(3,3-difluoropiperidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278370 CHEMBL571805 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(3-fluoroazetidin-1-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278383 CHEMBL601687 Bioactive AGN-PC-07R98R
CFAMM00278396 CHEMBL601684 Bioactive (2S)-2-[[(2S,4R)-4-(azepan-1-yl)-1-(3-cyanophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278349 CHEMBL445303 Bioactive (2S)-2-[[(2S,4R)-4-(cyclobutylamino)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278363 CHEMBL601470 Bioactive (2S)-2-[[(2S,4R)-1-(3-cyanophenyl)sulfonyl-4-(tetrazol-2-yl)pyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278376 CHEMBL589750 Bioactive SureCN4398870
CFAMM00278389 CHEMBL448863 Bioactive (2S)-2-[[(2S,4R)-1-(3,5-dichlorophenyl)sulfonyl-4-piperidin-1-ylpyrrolidine-2-carbonyl]amino]-3-[4-[(3,5-dichloropyridine-4-carbonyl)amino]phenyl]propanoic acid
CFAMM00278342 CHEMBL293756 Bioactive (2S)-3-[4-[(4-chloropyridine-3-carbonyl)amino]phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
CFAMM00278382 CHEMBL56520 Bioactive (2S)-3-[4-[(3,5-dichloro-1-methylpyridin-1-ium-4-carbonyl)amino]phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
CFAMM00278353 DNC009710 Investigative Drug MK-0668

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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