BDBM50442831 CHEMBL2440753

SMILES: NCc1ccc(cc1-c1cccc(c1)C(=O)OCC1CCCC1)C(=O)Nc1ccncc1

InChI Key: InChIKey=RZYKWEDHSAVJGB-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50442831   

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))	BDBM50442831 (CHEMBL2440753) Show SMILES NCc1ccc(cc1-c1cccc(c1)C(=O)OCC1CCCC1)C(=O)Nc1ccncc1 Show InChI InChI=1S/C26H27N3O3/c27-16-22-9-8-20(25(30)29-23-10-12-28-13-11-23)15-24(22)19-6-3-7-21(14-19)26(31)32-17-18-4-1-2-5-18/h3,6-15,18H,1-2,4-5,16-17,27H2,(H,28,29,30)	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	5	n/a	n/a	n/a	n/a	n/a	n/a
Amakem N.V. Curated by ChEMBL					Assay Description Inhibition of ROCK2 (unknown origin) using long S6 kinase peptide as substrate by radiometric assay				Bioorg Med Chem Lett 23: 6442-6 (2013) Article DOI: 10.1016/j.bmcl.2013.09.040 BindingDB Entry DOI: 10.7270/Q2BC411W
					More data for this Ligand-Target Pair