BDBM41639 MLS000075167::N-Cyclopentyl-2-[5-(5-methyl-isoxazol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-acetamide::N-cyclopentyl-2-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide::N-cyclopentyl-2-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide::N-cyclopentyl-2-[[5-(5-methyl-3-isoxazolyl)-1,3,4-oxadiazol-2-yl]thio]acetamide::N-cyclopentyl-2-[[5-(5-methylisoxazol-3-yl)-1,3,4-oxadiazol-2-yl]thio]acetamide::SMR000008274::cid_647358

SMILES Cc1cc(N2CCOC[C@@H]2C(F)(F)F)cc(F)c1C(=O)N[C@@H](Cc1ccc(-n2c(=O)c3cccnc3n(C)c2=O)c2ncccc12)C(=O)O

InChI Key InChIKey=DCIBYKPFOAKZRE-UHFFFAOYSA-N

Data  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 41639   

TargetIntegrin alpha-4/beta-7(Human)
Gilead Sciences

US Patent
LigandChemical structure of BindingDB Monomer ID 41639BDBM41639(US11116760, Example 402)
Affinity DataEC50:  0.100nMAssay Description:To measure 5-HT1E activity, a Chinese Hamster Ovary (CHO) cell line was developed at the Scripps Molecular Research Institute Screening center. This ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2026
Entry Details
US Patent