BDBM50345900 CHEMBL1783837::N-cyclopropyl-4-(4-((1R,2R)-2-(dimethylamino)cyclopentylamino)-5-(trifluoromethyl)pyrimidin-2-ylamino)benzenesulfonamide

SMILES: CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NC2CC2)ncc1C(F)(F)F

InChI Key: InChIKey=HSRFESCGWSJMOZ-QZTJIDSGSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50345900   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Protein-tyrosine kinase 2-beta (Homo sapiens (Human))	BDBM50345900 (CHEMBL1783837 | N-cyclopropyl-4-(4-((1R,2R)-2-(dim...) Show SMILES CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NC2CC2)ncc1C(F)(F)F |r| Show InChI InChI=1S/C21H27F3N6O2S/c1-30(2)18-5-3-4-17(18)27-19-16(21(22,23)24)12-25-20(28-19)26-13-8-10-15(11-9-13)33(31,32)29-14-6-7-14/h8-12,14,17-18,29H,3-7H2,1-2H3,(H2,25,26,27,28)/t17-,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PYK2 assessed as reduction in peptide substrate phosphoryltion by fluorimetric method				Bioorg Med Chem Lett 19: 3253-8 (2009) Article DOI: 10.1016/j.bmcl.2009.04.093 BindingDB Entry DOI: 10.7270/Q2GH9J96
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM50345900 (CHEMBL1783837 | N-cyclopropyl-4-(4-((1R,2R)-2-(dim...) Show SMILES CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NC2CC2)ncc1C(F)(F)F |r| Show InChI InChI=1S/C21H27F3N6O2S/c1-30(2)18-5-3-4-17(18)27-19-16(21(22,23)24)12-25-20(28-19)26-13-8-10-15(11-9-13)33(31,32)29-14-6-7-14/h8-12,14,17-18,29H,3-7H2,1-2H3,(H2,25,26,27,28)/t17-,18-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of purified activated FAK kinase domain (410-689) using ATP and Glu and Tyr random peptide polymer substrate by fluorescence polarization ...				Bioorg Med Chem Lett 19: 3253-8 (2009) Article DOI: 10.1016/j.bmcl.2009.04.093 BindingDB Entry DOI: 10.7270/Q2GH9J96
					More data for this Ligand-Target Pair
Protein-tyrosine kinase 2-beta (Homo sapiens (Human))	BDBM50345900 (CHEMBL1783837 | N-cyclopropyl-4-(4-((1R,2R)-2-(dim...) Show SMILES CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NC2CC2)ncc1C(F)(F)F |r| Show InChI InChI=1S/C21H27F3N6O2S/c1-30(2)18-5-3-4-17(18)27-19-16(21(22,23)24)12-25-20(28-19)26-13-8-10-15(11-9-13)33(31,32)29-14-6-7-14/h8-12,14,17-18,29H,3-7H2,1-2H3,(H2,25,26,27,28)/t17-,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PYK2 by PYK2-LI-COR cellular assay				Bioorg Med Chem Lett 19: 3253-8 (2009) Article DOI: 10.1016/j.bmcl.2009.04.093 BindingDB Entry DOI: 10.7270/Q2GH9J96
					More data for this Ligand-Target Pair