BDBM475795 US10849881, Example 1.068::[(3aS,3bS,6aR,6bR)-5-(1H-benzotriazole- 5-carbonyl)-octahydro-cyclobuta[1,2-c;3,4- c']dipyrrol-2-yl]-(6-chloro-9H-carbazol-2- yl)-methanone

SMILES c1cc2c3cc(ccc3[nH]c2cc1C(=O)N4C[C@@H]5[C@H](C4)[C@@H]6[C@H]5CN(C6)C(=O)c7ccc8c(c7)nn[nH]8)Cl

InChI Key InChIKey=UCSZLTVMEILRKY-UHFFFAOYSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 475795   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 475795BDBM475795([(3aS,3bS,6aR,6bR)-5-(1H-benzotriazole- 5-carbonyl...)
Affinity DataIC50: 14.3nMAssay Description:ATX inhibition was measured by a fluorescence quenching assay using a specifically labeled substrate analogue (MR121 substrate). To obtain this MR121...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/13/2021
Entry Details
US Patent
PDB3D3D Structure (crystal)