null

SMILES: FC(F)(F)c1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc3[nH]ccc23)c1

InChI Key: InChIKey=IIRWSDZCKFCCRO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50541286   

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))	BDBM50541286 (CHEMBL4648713) Show SMILES FC(F)(F)c1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc3[nH]ccc23)c1 Show InChI InChI=1S/C21H13F3N4OS/c22-21(23,24)13-3-1-2-12(8-13)10-28-11-27-19-16(20(28)29)9-17(30-19)14-4-6-25-18-15(14)5-7-26-18/h1-9,11H,10H2,(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	7	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))	BDBM50541286 (CHEMBL4648713) Show SMILES FC(F)(F)c1cccc(Cn2cnc3sc(cc3c2=O)-c2ccnc3[nH]ccc23)c1 Show InChI InChI=1S/C21H13F3N4OS/c22-21(23,24)13-3-1-2-12(8-13)10-28-11-27-19-16(20(28)29)9-17(30-19)14-4-6-25-18-15(14)5-7-26-18/h1-9,11H,10H2,(H,25,26)	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	110	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