BDBM50431160 CHEMBL2332083

SMILES: O=C(Nc1ccc(cc1)-c1cn[nH]c1)N1CCc2ccccc2C1

InChI Key: InChIKey=KITGKRAVFNXHDT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50431160   

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))	BDBM50431160 (CHEMBL2332083) Show SMILES O=C(Nc1ccc(cc1)-c1cn[nH]c1)N1CCc2ccccc2C1 Show InChI InChI=1S/C19H18N4O/c24-19(23-10-9-14-3-1-2-4-16(14)13-23)22-18-7-5-15(6-8-18)17-11-20-21-12-17/h1-8,11-12H,9-10,13H2,(H,20,21)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	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
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50431160 (CHEMBL2332083) Show SMILES O=C(Nc1ccc(cc1)-c1cn[nH]c1)N1CCc2ccccc2C1 Show InChI InChI=1S/C19H18N4O/c24-19(23-10-9-14-3-1-2-4-16(14)13-23)22-18-7-5-15(6-8-18)17-11-20-21-12-17/h1-8,11-12H,9-10,13H2,(H,20,21)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2 (unknown origin) after 4 hrs by HTRF assay				J Med Chem 56: 3568-81 (2013) Article DOI: 10.1021/jm400062r BindingDB Entry DOI: 10.7270/Q28C9XMJ
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50431160 (CHEMBL2332083) Show SMILES O=C(Nc1ccc(cc1)-c1cn[nH]c1)N1CCc2ccccc2C1 Show InChI InChI=1S/C19H18N4O/c24-19(23-10-9-14-3-1-2-4-16(14)13-23)22-18-7-5-15(6-8-18)17-11-20-21-12-17/h1-8,11-12H,9-10,13H2,(H,20,21)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	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