BDBM50417673 CHEMBL1643360

SMILES: COc1ccc(CCNCc2ccc3c(N)nccc3c2)cc1

InChI Key: InChIKey=JTDVQNNRBCWZHD-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 = 50417673   

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 1 (Homo sapiens (Human))	BDBM50417673 (CHEMBL1643360) Show SMILES COc1ccc(CCNCc2ccc3c(N)nccc3c2)cc1 Show InChI InChI=1S/C19H21N3O/c1-23-17-5-2-14(3-6-17)8-10-21-13-15-4-7-18-16(12-15)9-11-22-19(18)20/h2-7,9,11-12,21H,8,10,13H2,1H3,(H2,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
MSD Curated by ChEMBL					Assay Description Inhibition of ROCK-1 by Immobilized metal ion affinity-based fluorescence polarization assay				Bioorg Med Chem Lett 21: 97-101 (2010) Article DOI: 10.1016/j.bmcl.2010.11.060 BindingDB Entry DOI: 10.7270/Q29W0GQK
					More data for this Ligand-Target Pair