null

SMILES: COc1cccc(CNC(=O)c2cc3ccc(cc3[nH]2)-c2ccnc(N)c2)c1

InChI Key: InChIKey=ZVZXPIZWXYASPP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50358472   

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))	BDBM50358472 (CHEMBL1923161) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3[nH]2)-c2ccnc(N)c2)c1 Show InChI InChI=1S/C22H20N4O2/c1-28-18-4-2-3-14(9-18)13-25-22(27)20-11-17-6-5-15(10-19(17)26-20)16-7-8-24-21(23)12-16/h2-12,26H,13H2,1H3,(H2,23,24)(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7107-12 (2011) Article DOI: 10.1016/j.bmcl.2011.09.083 BindingDB Entry DOI: 10.7270/Q20002H5
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358472 (CHEMBL1923161) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3[nH]2)-c2ccnc(N)c2)c1 Show InChI InChI=1S/C22H20N4O2/c1-28-18-4-2-3-14(9-18)13-25-22(27)20-11-17-6-5-15(10-19(17)26-20)16-7-8-24-21(23)12-16/h2-12,26H,13H2,1H3,(H2,23,24)(H,25,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of human 6-His-tagged ROCK2 expressed in Sf9 cells				Bioorg Med Chem Lett 21: 7107-12 (2011) Article DOI: 10.1016/j.bmcl.2011.09.083 BindingDB Entry DOI: 10.7270/Q20002H5
					More data for this Ligand-Target Pair