BDBM117665 US8653087, III-345

SMILES: Cc1ccc(cc1Nc1ncnc2cnc(nc12)N1CC[C@H](F)C1)C(=O)Nc1cc(ccn1)C(F)(F)F

InChI Key: InChIKey=CMTLDJKXZSJZFE-INIZCTEOSA-N

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 = 117665   

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
B-RAF V600E (Homo sapiens (Human))	BDBM117665 (US8653087, III-345) Show SMILES Cc1ccc(cc1Nc1ncnc2cnc(nc12)N1CC[C@H](F)C1)C(=O)Nc1cc(ccn1)C(F)(F)F |r| Show InChI InChI=1S/C24H20F4N8O/c1-13-2-3-14(22(37)34-19-9-15(4-6-29-19)24(26,27)28)8-17(13)33-21-20-18(31-12-32-21)10-30-23(35-20)36-7-5-16(25)11-36/h2-4,6,8-10,12,16H,5,7,11H2,1H3,(H,29,34,37)(H,31,32,33)/t16-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The final concentration of DMSO is 5%. 10 μL of the B-Raf (V600E)-kinase solution are pipetted in (containing 0.5 ng B-Raf (V600E)-kinase in 20 ...				US Patent US8653087 (2014) BindingDB Entry DOI: 10.7270/Q2CR5S1G
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