CFam Chemical Families Database
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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 CFFBM13382
Family Name Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[2-(diethylamino)-5-[dimethylcarbamoyl(ethyl)amino]pyrimidin-4-yl]amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propanoic acid family
No. of Seeds 12 No. of Other Members 2
Family Centroid CFAMM00380575 Functional Category Bioactive
Superfamily Mitogen-activated protein kinase 8 Inhibitor 2-(2-phenoxypyrimidin-4-ylamino)benzoic Acid Superfamily
Class Class 850

Cousin Family NamesSeedsMembers
Gamma-secretase subunit APH-1B Inhibitor E2012 Family 3 67
Smoothened homolog Inhibitor LDE225 Family 3 76
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subun... 11 10
Peroxisome proliferator-activated receptor gamma and Peroxisom... 15 94
Integrin alpha-V and Integrin beta-1 Inhibitor SB-265123 Family 30 170
Adenosine receptor A1 and Adenosine receptor A2a Ligand N-(2-(... 21 108
Nitric oxide synthase, inducible and Nitric oxide synthase, br... 2 3
Reverse transcriptase Inhibitor Atevirdine Family 4 55
Metabotropic glutamate receptor 5 Ligand 3-methoxy-n-(6-methyl... 3 15
Integrin beta-3 and Integrin alpha-V inhibitor methyl (3S)-3-(... 12 13
Alpha-1B adrenergic receptor and Alpha-1D adrenergic receptor ... 6 35
Peroxisome proliferator-activated receptor delta ligand SureCN... 8 19
Tyrosine-protein kinase JAK3 and Tyrosine-protein kinase JAK2 ... 1 11
Tyrosine-protein kinase JAK3 and Tyrosine-protein kinase JAK2 ... 2 6
Dihydrofolate reductase inhibitor 10-Oxaaminopterin family 1 2
Mitogen-activated protein kinase 14 inhibitor N-(4-aminobutyl)... 1 28
Lysine--tRNA ligase and Dual specificity protein kinase CLK4 i... 4 27
Aurora kinase A inhibitor SureCN761545 family 2 2
Disintegrin and metalloproteinase domain-containing protein 17... 2 6
Angiopoietin-1 receptor and Aurora kinase B ligand SureCN12658... 3 19
Survival motor neuron protein inhibitor CHEMBL1307497 family 1 2
Thyroid hormone receptor beta and Ferritin light chain ligand ... 1 35
D(3) dopamine receptor and D(2) dopamine receptor ligand SureC... 5 4
Thyroid hormone receptor beta and Cruzipain ligand CHEMBL14730... 1 12
Prostaglandin D2 receptor ligand 1-[3-[2-methoxy-6-[2-(4-metho... 6 16
Prostaglandin D2 receptor ligand 2-methoxy-N-[2-(4-methoxyphen... 2 2
Adenosine receptor A3 ligand AGN-PC-08WSLM family 5 22
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subun... 2 2
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[2-(die... 4 40
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-(dime... 2 2
Integrin beta-1 and Integrin alpha-4 inhibitor SureCN2059024 f... 6 3
Cholecystokinin receptor type A ligand AGN-PC-0A9S2C family 4 8
Serine/threonine-protein kinase PLK1 inhibitor AGN-PC-0A9RFQ f... 2 1
Integrin alpha-V and Integrin beta-5 inhibitor SureCN2491273 f... 11 10
Corticotropin-releasing factor receptor 1 ligand AGN-PC-009TSL... 3 3
Serine/threonine-protein kinase RIO2 and Serine/threonine-prot... 12 13
Rho-associated protein kinase 1 and cAMP-dependent protein kin... 1 11
Serine/threonine-protein kinase TBK1 and Inhibitor of nuclear ... 2 8
Integrin beta-1 and Integrin alpha-5 inhibitor (2S)-2-[(4-fluo... 7 1
Glycogen synthase kinase-3 beta inhibitor 2-(4-fluorophenyl)-N... 7 3
Smoothened homolog and Mitogen-activated protein kinase 14 inh... 7 11
Tyrosine-protein kinase Lck and Proto-oncogene tyrosine-protei... 6 13
Rho-associated protein kinase 1 inhibitor SureCN4007647 family 8 4
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10... 2 1
Angiopoietin-1 receptor and Vascular endothelial growth factor... 4 8
Nitric oxide synthase, inducible inhibitor SureCN5194847 family 24 48
Nitric oxide synthase, inducible inhibitor 2-[1-(2-imidazol-1-... 4 3
Glycogen synthase kinase-3 beta and Casein kinase I isoform ga... 3 0
Nitric oxide synthase, inducible inhibitor N-(1,3-benzodioxol-... 11 1
Vascular endothelial growth factor receptor 2 and Serine/threo... 6 13
Peroxisome proliferator-activated receptor gamma and Peroxisom... 3 0
Receptor tyrosine-protein kinase erbB-2 ligand SureCN4461871 f... 2 2
Adenosine receptor A2a and Cytochrome P450 3A4 ligand N-[6-(3,... 5 2
G-protein coupled bile acid receptor 1 ligand 2-ethyl-6-[3-[4-... 4 6
Tyrosine-protein kinase ABL1 and Breakpoint cluster region pro... 8 5
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[2-(die... 1 0
Diacylglycerol O-acyltransferase 1 inhibitor 4-[5-[5-(1H-benzi... 7 1
Angiopoietin-1 receptor and Vascular endothelial growth factor... 5 0
Mitogen-activated protein kinase 14 inhibitor SureCN4913214 fa... 1 2
Gonadotropin-releasing hormone receptor ligand 2-tert-butyl-8-... 6 23
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-(2,6-... 3 15
Dihydrofolate reductase and Bifunctional dihydrofolate reducta... 5 12
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-(2,6-... 1 0
Cannabinoid receptor 2 ligand AGN-PC-03LKW5 family 24 5
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-3-[4-(2,6-... 3 1
Rho-associated protein kinase 2 inhibitor AGN-PC-078WHL family 3 1
Translocator protein inhibitor AGN-PC-04X3HY family 10 1
Adenosine receptor A2a and Adenosine receptor A1 ligand SureCN... 3 5
Acyl-CoA desaturase inhibitor SureCN1182546 family 2 5
cGMP-specific 3',5'-cyclic phosphodiesterase inhibitor AGN-PC-... 7 6
C-C chemokine receptor type 8 and Potassium voltage-gated chan... 1 3
Matrilysin and 72 kDa type IV collagenase inhibitor (3S,6R,7S)... 2 2
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[3,4-di... 2 0
Protein kinase C theta type inhibitor SureCN3953579 family 2 1
Dihydrofolate reductase inhibitor AGN-PC-073PP8 family 1 0


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00422093 CHEMBL2408066 Bioactive (2S)-2-[[2-(diethylamino)-5-[ethyl(morpholine-4-carbonyl)amino]pyrimidin-4-yl]amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propanoic acid
CFAMM00422095 CHEMBL2408064 Bioactive (2S)-2-[[2-(diethylamino)-5-[diethylcarbamoyl(ethyl)amino]pyrimidin-4-yl]amino]-3-[4-(pyrrolidine-1-carbonyloxy)phenyl]propanoic acid

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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