BDBM341037 N-(4-Hydroxyphenyl)-5-methyl-N-(1-methyl-1H-indol-5-yl)-1-(6-{[(3S)-3-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}-1,3-benzodioxol-5-yl)-1H-pyrrole-3-carboxamide::US9765056, Example 90

SMILES: CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-n2cc(cc2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1

InChI Key: InChIKey=FIBRNFKPOAXIIC-BHVANESWSA-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 = 341037   

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))	BDBM341037 (N-(4-Hydroxyphenyl)-5-methyl-N-(1-methyl-1H-indol-...) Show SMILES CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-n2cc(cc2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1 Show InChI InChI=1S/C44H44N6O5/c1-29-20-33(43(52)50(34-8-11-37(51)12-9-34)35-10-13-39-31(22-35)14-15-46(39)3)26-48(29)40-24-42-41(54-28-55-42)23-38(40)44(53)49-25-32-7-5-4-6-30(32)21-36(49)27-47-18-16-45(2)17-19-47/h4-15,20,22-24,26,36,51H,16-19,21,25,27-28H2,1-3H3/t36-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.60	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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