BDBM489360 Example 10-15::US10961242, Compound 75

SMILES OC(=O)c1nn(CC(=O)N2CCc3[nH]nnc3C2)cc1-c1cnc(NC2Cc3ccccc3C2)nc1

InChI Key InChIKey=PQVHMOLNSYFXIJ-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 489360   

TargetAutotaxin(Human)
Legochem Biosciences

US Patent
LigandPNGBDBM489360(US10961242, Compound 75 | Example 10-15)
Affinity DataIC50: 1.5nMAssay Description:Two-fold dilution of each test compound solution (10 μM, 100% dimethyl sulfoxide) is carried out on 96-well V bottom plate (Costar 3363). After ...More data for this Ligand-Target Pair
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Date in BDB:
10/4/2021
Entry Details
US Patent