BDBM50324597 CHEMBL1215239::rac-N-(2-(2-(Dimethylamino)ethoxy)-4-(1H-pyrazol-4-yl)phenyl)-8-methoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxamide

SMILES: COc1cccc2CC(NCc12)C(=O)Nc1ccc(cc1OCCN(C)C)-c1cn[nH]c1

InChI Key: InChIKey=AMNIVLUAYOFKBK-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50324597   

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
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50324597 (CHEMBL1215239 | rac-N-(2-(2-(Dimethylamino)ethoxy)...) Show SMILES COc1cccc2CC(NCc12)C(=O)Nc1ccc(cc1OCCN(C)C)-c1cn[nH]c1 Show InChI InChI=1S/C24H29N5O3/c1-29(2)9-10-32-23-12-16(18-13-26-27-14-18)7-8-20(23)28-24(30)21-11-17-5-4-6-22(31-3)19(17)15-25-21/h4-8,12-14,21,25H,9-11,15H2,1-3H3,(H,26,27)(H,28,30)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	261	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				J Med Chem 53: 5727-37 (2010) Article DOI: 10.1021/jm100579r BindingDB Entry DOI: 10.7270/Q2833S8C
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