BDBM341016 1-(5-Bromo-2-{[(3S)-3-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}phenyl)-N-(4-hydroxyphenyl)-5-methyl-N-(1-methyl-1H-indol-5-yl)-1H-pyrrole-3-carboxamide hydrochloride::US9765056, Example 70

SMILES: CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Br)cc2-n2cc(cc2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1

InChI Key: InChIKey=JWADGWWNTVXKTG-QNGWXLTQSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 341016   

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
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM341016 (1-(5-Bromo-2-{[(3S)-3-[(4-methylpiperazin-1-yl)met...) Show SMILES CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Br)cc2-n2cc(cc2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1 Show InChI InChI=1S/C43H43BrN6O3/c1-29-22-33(42(52)50(35-9-12-38(51)13-10-35)36-11-15-40-31(24-36)16-17-46(40)3)27-48(29)41-25-34(44)8-14-39(41)43(53)49-26-32-7-5-4-6-30(32)23-37(49)28-47-20-18-45(2)19-21-47/h4-17,22,24-25,27,37,51H,18-21,23,26,28H2,1-3H3/t37-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD US Patent					Assay Description Method A:The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 c...				US Patent US9765056 (2017) BindingDB Entry DOI: 10.7270/Q2T72KJF
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