BDBM50026211 CHEMBL1276184

SMILES: [H][C@]12CN(c3ccc(c(C)c3)-c3ccnc4c(c(nn34)-c3ccncc3)-c3ccc(F)c4[nH]ncc34)[C@]([H])(CN1C)C2

InChI Key:

Data: 1 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 1 hit for monomerid = 50026211   

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))	BDBM50026211 (CHEMBL1276184) Show SMILES [H][C@]12CN(c3ccc(c(C)c3)-c3ccnc4c(c(nn34)-c3ccncc3)-c3ccc(F)c4[nH]ncc34)[C@]([H])(CN1C)C2 |r,wU:36.42,1.0,(-6.99,-8.62,;-8.07,-9.72,;-8.07,-11.26,;-9.4,-12.03,;-9.39,-13.57,;-8.05,-14.33,;-8.05,-15.87,;-9.39,-16.65,;-10.72,-15.89,;-12.05,-16.66,;-10.73,-14.35,;-9.38,-18.18,;-10.71,-18.95,;-10.71,-20.5,;-9.37,-21.27,;-8.04,-20.5,;-6.56,-20.98,;-5.65,-19.72,;-6.56,-18.47,;-8.04,-18.95,;-4.11,-19.72,;-3.34,-21.06,;-1.8,-21.06,;-1.03,-19.72,;-1.81,-18.38,;-3.35,-18.39,;-6.09,-22.44,;-4.59,-22.76,;-4.11,-24.22,;-5.14,-25.37,;-4.66,-26.84,;-6.65,-25.05,;-7.89,-25.95,;-9.13,-25.04,;-8.65,-23.58,;-7.11,-23.59,;-10.73,-11.27,;-12.28,-11.27,;-10.75,-9.74,;-9.41,-8.95,;-9.42,-7.41,;-9.65,-10.17,)| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<0.320	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRAF				J Med Chem 53: 7874-8 (2010) Article DOI: 10.1021/jm1007566 BindingDB Entry DOI: 10.7270/Q2HM58Q3
					More data for this Ligand-Target Pair