BDBM41638 3-(3-Methyl-benzoylamino)-9-aza-bicyclo[3.3.1]nonane-9-carboxylic acid cyclohexylamide::MLS000074250::N-cyclohexyl-3-(m-toluoylamino)-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[(3-methylbenzoyl)amino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[(3-methylphenyl)carbonylamino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[[(3-methylphenyl)-oxomethyl]amino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::SMR000006243::cid_647078

SMILES Cc1cc(N2CCOC[C@@H]2C(F)(F)F)cc(F)c1C(=O)N[C@@H](Cc1ccc(-n2c(=O)c3cnccc3n(C)c2=O)c2ncccc12)C(=O)O

InChI Key InChIKey=UAUHAXQFAHPNTI-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 = 41638   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 41638BDBM41638(US11116760, Example 401)
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