BDBM215698 US9296748, I-34::US9296748, I-39

SMILES: C[C@@H](c1ccccc1)n1c(nc2ccc(cc12)C1CN(C)CCO1)-c1cc(C)c(=O)n(C)c1

InChI Key: InChIKey=JYEVMSAUPGGEIB-UBDBMELISA-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 = 215698   

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
Bromodomain-containing protein 4 (BRD4) (aa 44-168) (Homo sapiens (Human))	BDBM215698 (US9296748, I-34 | US9296748, I-39) Show SMILES C[C@@H](c1ccccc1)n1c(nc2ccc(cc12)C1CN(C)CCO1)-c1cc(C)c(=O)n(C)c1 |r| Show InChI InChI=1S/C27H30N4O2/c1-18-14-22(16-30(4)27(18)32)26-28-23-11-10-21(25-17-29(3)12-13-33-25)15-24(23)31(26)19(2)20-8-6-5-7-9-20/h5-11,14-16,19,25H,12-13,17H2,1-4H3/t19-,25?/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 μM start concentration) in white OptiPlate-384 (Perki...				US Patent US9296748 (2016) BindingDB Entry DOI: 10.7270/Q21G0K4K
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (BRD4) (aa 44-168) (Homo sapiens (Human))	BDBM215698 (US9296748, I-34 | US9296748, I-39) Show SMILES C[C@@H](c1ccccc1)n1c(nc2ccc(cc12)C1CN(C)CCO1)-c1cc(C)c(=O)n(C)c1 |r| Show InChI InChI=1S/C27H30N4O2/c1-18-14-22(16-30(4)27(18)32)26-28-23-11-10-21(25-17-29(3)12-13-33-25)15-24(23)31(26)19(2)20-8-6-5-7-9-20/h5-11,14-16,19,25H,12-13,17H2,1-4H3/t19-,25?/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	142	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 μM start concentration) in white OptiPlate-384 (Perki...				US Patent US9296748 (2016) BindingDB Entry DOI: 10.7270/Q21G0K4K
					More data for this Ligand-Target Pair