BDBM213497 US9278981, 89

SMILES: OC[C@H]1CCN(C1)c1ncc(cc1-c1cnc(Cl)c(F)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=MAXSMFFJPDUOMK-ZDUSSCGKSA-N

Data: 2 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 2 hits for monomerid = 213497   

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
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM213497 (US9278981, 89) Show SMILES OC[C@H]1CCN(C1)c1ncc(cc1-c1cnc(Cl)c(F)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 |r| Show InChI InChI=1S/C23H19ClF4N4O3/c24-20-19(25)8-14(9-29-20)18-7-15(10-30-21(18)32-6-5-13(11-32)12-33)22(34)31-16-1-3-17(4-2-16)35-23(26,27)28/h1-4,7-10,13,33H,5-6,11-12H2,(H,31,34)/t13-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.300	n/a	n/a	n/a	n/a	7.5	30
Novartis AG US Patent					Assay Description The assay plates were prepared by addition of 50 nL per well of compound solution in 90% DMSO. The kinase reactions were started by stepwise addition...				US Patent US9278981 (2016) BindingDB Entry DOI: 10.7270/Q2DV1HRD
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM213497 (US9278981, 89) Show SMILES OC[C@H]1CCN(C1)c1ncc(cc1-c1cnc(Cl)c(F)c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 |r| Show InChI InChI=1S/C23H19ClF4N4O3/c24-20-19(25)8-14(9-29-20)18-7-15(10-30-21(18)32-6-5-13(11-32)12-33)22(34)31-16-1-3-17(4-2-16)35-23(26,27)28/h1-4,7-10,13,33H,5-6,11-12H2,(H,31,34)/t13-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	7.5	25
Novartis AG US Patent					Assay Description For determination of ABL kinase activity, the radiometric filter-binding assay was used. The assay was performed by mixing 10 uL of the compound pre-...				US Patent US9278981 (2016) BindingDB Entry DOI: 10.7270/Q2DV1HRD
					More data for this Ligand-Target Pair