BDBM321400 6-[(E)-but-2-enyl]-4-[4-(1-hydroxy-1-methyl-ethyl)-2-methoxy-phenyl]-1H-pyrrolo[2,3-e]pyridin-7-one::US10183009, Example 79

SMILES: COc1cc(ccc1-n1cc(C\C=C\C)c(=O)c2[nH]ccc12)C(C)(C)O

InChI Key: InChIKey=ZUOHLDHVUOZNKI-AATRIKPKSA-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 = 321400   

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
BRD9 (aa 134-239) (Homo sapiens (Human))	BDBM321400 (6-[(E)-but-2-enyl]-4-[4-(1-hydroxy-1-methyl-ethyl)...) Show SMILES COc1cc(ccc1-n1cc(C\C=C\C)c(=O)c2[nH]ccc12)C(C)(C)O Show InChI InChI=1S/C21H24N2O3/c1-5-6-7-14-13-23(17-10-11-22-19(17)20(14)24)16-9-8-15(21(2,3)25)12-18(16)26-4/h5-6,8-13,22,25H,7H2,1-4H3/b6-5+	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC.; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10183009 (2019) BindingDB Entry DOI: 10.7270/Q2125VRQ
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