BDBM50660110 CHEMBL6168974

SMILES CCCC[C@@H]1NC(=O)[C@H]2CC[C@H](C2)NC(=O)[C@](C)([C@@H](C)c2c[nH]c3c(OC)cccc23)NC(=O)CN(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(C(=O)O)cc2)NC(=O)[C@](C)(CO)NC(=O)[C@H](Cc2c[nH]c3c(Cl)cccc23)NC(=O)[C@H](Cc2ccncc2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CNCCN2C(=O)[C@H](Cc2ccncc2)NC1=O

InChI Key InChIKey=RANFDZQNIHLBEW-UHFFFAOYSA-N

Data  1 IC50  2 Kd

  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 3 hits for monomerid = 50660110   

TargetTumor necrosis factor receptor superfamily member 1A(Human)
Emory University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50660110BDBM50660110(CHEMBL6168974)
Affinity DataKd:  0.100nMAssay Description:Binding affinity to C-terminal Avi-tagged human TNFRl extracted from Sf21 baculovirus expression system assessed as dissociation constant incubated f...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetTumor necrosis factor receptor superfamily member 1A(Human)
Emory University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50660110BDBM50660110(CHEMBL6168974)
Affinity DataIC50: 0.200nMAssay Description:Displacement of biotinylated peptide from C-terminal 6His-tagged human soluble TNFR1 (1 to 211 residues) extracted from Sf21 baculovirus expression s...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetTumor necrosis factor receptor superfamily member 1B(Homo sapiens)
Emory University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50660110BDBM50660110(CHEMBL6168974)
Affinity DataKd: >1.00E+3nMAssay Description:Binding affinity to C-terminal Avi-tagged human TNFR2 extracted from Sf21 baculovirus expression system assessed as dissociation constant incubated f...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed