BDBM314071 US9610264, Compound 7

SMILES: CC1(NC(=O)N(CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)C1=O)c1ccc(F)cc1

InChI Key: InChIKey=XAENZKDUGMVTAX-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 314071   

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
Integrin α4β7 (Homo sapiens (Human))	BDBM314071 (US9610264, Compound 7) Show SMILES CC1(NC(=O)N(CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)C1=O)c1ccc(F)cc1 Show InChI InChI=1S/C26H23FN4O4/c1-26(18-11-13-19(27)14-12-18)24(34)31(25(35)30-26)16-22(32)29-21-10-6-5-9-20(21)23(33)28-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,28,33)(H,29,32)(H,30,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	0.980	n/a	n/a	n/a	n/a	n/a	n/a
KFLP BIOTECH, LLC US Patent					Assay Description The studies began by screening for the optimal protein concentrations for the method. The studies were conducted in goat anti-mouse IgG coated black ...				US Patent US9610264 (2017) BindingDB Entry DOI: 10.7270/Q2KH0QD4
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