BDBM126989 US8785459, 64

SMILES: COc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1

InChI Key: InChIKey=YOVFBIUTXSMTJA-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 = 126989   

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
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM126989 (US8785459, 64) Show SMILES COc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1 Show InChI InChI=1S/C21H17N3O2/c1-26-18-8-5-14(6-9-18)15-7-10-20-19(11-15)21(23-13-22-20)24-16-3-2-4-17(25)12-16/h2-13,25H,1H3,(H,22,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	62.4	n/a	n/a	n/a	n/a	n/a	n/a
Development Center for Biotechnology US Patent					Assay Description Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...				US Patent US8785459 (2014) BindingDB Entry DOI: 10.7270/Q2M907BP
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM126989 (US8785459, 64) Show SMILES COc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1 Show InChI InChI=1S/C21H17N3O2/c1-26-18-8-5-14(6-9-18)15-7-10-20-19(11-15)21(23-13-22-20)24-16-3-2-4-17(25)12-16/h2-13,25H,1H3,(H,22,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
Development Center for Biotechnology US Patent					Assay Description Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...				US Patent US8785459 (2014) BindingDB Entry DOI: 10.7270/Q2M907BP
					More data for this Ligand-Target Pair
B-RAF V600E (Homo sapiens (Human))	BDBM126989 (US8785459, 64) Show SMILES COc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1 Show InChI InChI=1S/C21H17N3O2/c1-26-18-8-5-14(6-9-18)15-7-10-20-19(11-15)21(23-13-22-20)24-16-3-2-4-17(25)12-16/h2-13,25H,1H3,(H,22,23,24)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	105	n/a	n/a	n/a	n/a	n/a	n/a
Development Center for Biotechnology US Patent					Assay Description Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...				US Patent US8785459 (2014) BindingDB Entry DOI: 10.7270/Q2M907BP
					More data for this Ligand-Target Pair