BDBM50588610 CHEMBL5193114

SMILES COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)c2oc3c(OC)c(O)ccc3c2C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)NCCCCC(NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)c2oc3c(OC)c(OC)ccc3c2C)C(C)C)C(N)=O)cc1

InChI Key InChIKey=MERSKJOGNKRFGK-UHFFFAOYSA-N

Data  1 IC50

  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 = 50588610   

TargetEphrin type-A receptor 2(Human)
University of California Riverside

Curated by ChEMBL
LigandPNGBDBM50588610(CHEMBL5193114)
Affinity DataIC50: 80nMAssay Description:Inhibition of EPHA2 (unknown origin) by DELFIA assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed