BDBM50069139 CHEMBL3402463

SMILES: CCN(Cc1cccc(OC)c1)C(=O)Nc1ccc(cc1OCCN1CCCC1)-c1cn[nH]c1

InChI Key: InChIKey=MGHYDDQROZFWPN-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 = 50069139   

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))	BDBM50069139 (CHEMBL3402463) Show SMILES CCN(Cc1cccc(OC)c1)C(=O)Nc1ccc(cc1OCCN1CCCC1)-c1cn[nH]c1 Show InChI InChI=1S/C26H33N5O3/c1-3-31(19-20-7-6-8-23(15-20)33-2)26(32)29-24-10-9-21(22-17-27-28-18-22)16-25(24)34-14-13-30-11-4-5-12-30/h6-10,15-18H,3-5,11-14,19H2,1-2H3,(H,27,28)(H,29,32)	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	<1	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Institute of Technology Curated by ChEMBL					Assay Description Inhibition of ROCK2 (unknown origin) using STK2 substrate after 4 hrs by HTRF mode				Bioorg Med Chem 23: 2505-17 (2015) Article DOI: 10.1016/j.bmc.2015.03.047 BindingDB Entry DOI: 10.7270/Q2ZP47SX
					More data for this Ligand-Target Pair