BDBM209468 US10328074, Example III-9::US9266891, III-9

SMILES: CN1CCN(CC1)c1cc2n(Cc3ccccc3)c(nc2cn1)-c1cn2c(C)nnc2c(C)n1

InChI Key: InChIKey=GVSWCHHMYQOERK-UHFFFAOYSA-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 3 hits for monomerid = 209468   

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 [44-168]/Histone H4 (Homo sapiens (Human))	BDBM209468 (US10328074, Example III-9 | US11077107, Example II...) Show SMILES CN1CCN(CC1)c1cc2n(Cc3ccccc3)c(nc2cn1)-c1cn2c(C)nnc2c(C)n1 Show InChI InChI=1S/C25H27N9/c1-17-24-30-29-18(2)33(24)16-21(27-17)25-28-20-14-26-23(32-11-9-31(3)10-12-32)13-22(20)34(25)15-19-7-5-4-6-8-19/h4-8,13-14,16H,9-12,15H2,1-3H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	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 uM start concentration) in white OptiPlate-384 (PerkinElme...				US Patent US9266891 (2016) BindingDB Entry DOI: 10.7270/Q23X85G7
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [44-168] (Homo sapiens (Human))	BDBM209468 (US10328074, Example III-9 | US11077107, Example II...) Show SMILES CN1CCN(CC1)c1cc2n(Cc3ccccc3)c(nc2cn1)-c1cn2c(C)nnc2c(C)n1 Show InChI InChI=1S/C25H27N9/c1-17-24-30-29-18(2)33(24)16-21(27-17)25-28-20-14-26-23(32-11-9-31(3)10-12-32)13-22(20)34(25)15-19-7-5-4-6-8-19/h4-8,13-14,16H,9-12,15H2,1-3H3	PDB GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM209468 (US10328074, Example III-9 | US11077107, Example II...) Show SMILES CN1CCN(CC1)c1cc2n(Cc3ccccc3)c(nc2cn1)-c1cn2c(C)nnc2c(C)n1 Show InChI InChI=1S/C25H27N9/c1-17-24-30-29-18(2)33(24)16-21(27-17)25-28-20-14-26-23(32-11-9-31(3)10-12-32)13-22(20)34(25)15-19-7-5-4-6-8-19/h4-8,13-14,16H,9-12,15H2,1-3H3	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University					Assay Description This assay is used to determine whether the compounds inhibit the interaction between the first (BRD4-BD1) or the second (BRD4-BD2) bromodomain of BR...				Bioorg Med Chem 17: 7324-36 (2009) BindingDB Entry DOI: 10.7270/Q20Z75M2
					More data for this Ligand-Target Pair