null

SMILES: COc1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc(Cl)c2)c1

InChI Key: InChIKey=HUGJKZRIYIWAGB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50541278   

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))	BDBM50541278 (CHEMBL4646435) Show SMILES COc1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc(Cl)c2)c1 Show InChI InChI=1S/C19H14ClN3O2S/c1-25-14-4-2-3-12(7-14)10-23-11-22-18-15(19(23)24)9-16(26-18)13-5-6-21-17(20)8-13/h2-9,11H,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of recombinant human ROCK2 (11 to 552 residues) using KEAKEKRQEQIAKRRRLSSLRASTSKSGGSQK as substrate incubated for 40 mins in presence of [...				Bioorg Med Chem Lett 30: (2020)
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50541278 (CHEMBL4646435) Show SMILES COc1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc(Cl)c2)c1 Show InChI InChI=1S/C19H14ClN3O2S/c1-25-14-4-2-3-12(7-14)10-23-11-22-18-15(19(23)24)9-16(26-18)13-5-6-21-17(20)8-13/h2-9,11H,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of recombinant human ROCK1 (17 to 535 residues) using KEAKEKRQEQIAKRRRLSSLRASTSKSGGSQK as substrate incubated for 40 mins in presence of [...				Bioorg Med Chem Lett 30: (2020)
					More data for this Ligand-Target Pair