BDBM50204711 4-(6-(((1r,4r)-4-methylcyclohexylamino)methyl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenol::CHEMBL242736

SMILES: C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(O)cc2)c1

InChI Key: InChIKey=UZYWNMNHDXLFCZ-RHDGDCLCSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50204711   

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
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50204711 (4-(6-(((1r,4r)-4-methylcyclohexylamino)methyl)-1,4...) Show SMILES C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(-9.65,-1.94,;-8.31,-1.18,;-6.98,-1.95,;-5.64,-1.18,;-5.64,.35,;-6.97,1.13,;-8.3,.36,;-4.3,1.12,;-2.97,.35,;-1.64,1.11,;-1.63,2.66,;-.31,3.43,;1.03,2.66,;1.03,1.11,;2.5,.64,;3.42,1.88,;4.9,2.36,;4.9,3.92,;3.42,4.4,;2.5,3.14,;6.14,1.46,;5.97,-.07,;7.21,-.98,;8.62,-.35,;9.87,-1.26,;8.78,1.19,;7.54,2.09,;-.3,.34,)| Show InChI InChI=1S/C24H27N3O/c1-15-2-7-19(8-3-15)25-14-16-4-11-21-18(12-16)13-22-23(26-27-24(21)22)17-5-9-20(28)10-6-17/h4-6,9-12,15,19,25,28H,2-3,7-8,13-14H2,1H3,(H,26,27)/t15-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of Chk1				J Med Chem 52: 3159-65 (2009) Article DOI: 10.1021/jm801444x BindingDB Entry DOI: 10.7270/Q2FF3TM8
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50204711 (4-(6-(((1r,4r)-4-methylcyclohexylamino)methyl)-1,4...) Show SMILES C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(-9.65,-1.94,;-8.31,-1.18,;-6.98,-1.95,;-5.64,-1.18,;-5.64,.35,;-6.97,1.13,;-8.3,.36,;-4.3,1.12,;-2.97,.35,;-1.64,1.11,;-1.63,2.66,;-.31,3.43,;1.03,2.66,;1.03,1.11,;2.5,.64,;3.42,1.88,;4.9,2.36,;4.9,3.92,;3.42,4.4,;2.5,3.14,;6.14,1.46,;5.97,-.07,;7.21,-.98,;8.62,-.35,;9.87,-1.26,;8.78,1.19,;7.54,2.09,;-.3,.34,)| Show InChI InChI=1S/C24H27N3O/c1-15-2-7-19(8-3-15)25-14-16-4-11-21-18(12-16)13-22-23(26-27-24(21)22)17-5-9-20(28)10-6-17/h4-6,9-12,15,19,25,28H,2-3,7-8,13-14H2,1H3,(H,26,27)/t15-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of recombinant CHK1 assessed as human Cdc25C phosphorylation				Bioorg Med Chem 15: 2759-67 (2007) Article DOI: 10.1016/j.bmc.2007.01.012 BindingDB Entry DOI: 10.7270/Q2XS5V22
					More data for this Ligand-Target Pair