BDBM50309112 CHEMBL592701::N-(2-methoxyethyl)-N-methyl-3-(4-methyl-1,4-diazepan-1-yl)-5-(pyridin-4-yl)pyrazin-2-amine

SMILES: COCCN(C)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1

InChI Key: InChIKey=IXPHAKRKIKXIRR-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50309112   

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))	BDBM50309112 (CHEMBL592701 | N-(2-methoxyethyl)-N-methyl-3-(4-me...) Show SMILES COCCN(C)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C19H28N6O/c1-23-9-4-10-25(12-11-23)19-18(24(2)13-14-26-3)21-15-17(22-19)16-5-7-20-8-6-16/h5-8,15H,4,9-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309112 (CHEMBL592701 | N-(2-methoxyethyl)-N-methyl-3-(4-me...) Show SMILES COCCN(C)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C19H28N6O/c1-23-9-4-10-25(12-11-23)19-18(24(2)13-14-26-3)21-15-17(22-19)16-5-7-20-8-6-16/h5-8,15H,4,9-14H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair