BDBM50066483 (S)-2-Acetylamino-N-[(5S,12S,15S,18R,20aS)-18-cyclohexylmethyl-12-(3-guanidino-propyl)-15-(1H-indol-3-ylmethyl)-4,11,14,17,20-pentaoxo-icosahydro-3a,10,13,16,19-pentaaza-cyclopentacyclononadecen-5-yl]-3-phenyl-propionamide::CHEMBL334290

SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O

InChI Key InChIKey=OHIUSFUYXMQZOR-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50066483   

TargetC5a anaphylatoxin chemotactic receptor 1(Human)
University of Queensland

Curated by ChEMBL
LigandPNGBDBM50066483((S)-2-Acetylamino-N-[(5S,12S,15S,18R,20aS)-18-cycl...)
Affinity DataIC50: 90nMAssay Description:50% reduction in myeloperoxidase secretion from human PMNs mediated by 100 nM C5aMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC5a anaphylatoxin chemotactic receptor 1(Human)
University of Queensland

Curated by ChEMBL
LigandPNGBDBM50066483((S)-2-Acetylamino-N-[(5S,12S,15S,18R,20aS)-18-cycl...)
Affinity DataIC50: 3.20E+3nMAssay Description:50% reduction in binding of [125I]C5a to human polymorphonuclear cells (PMNs)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed