BDBM50030098 (R)-11-(4-Hydroxy-benzyl)-5-(1H-indol-3-ylmethyl)-17-isopropyl-hexadecahydro-3a,6,9,12,15,18,21-heptaaza-cyclopentacyclohenicosene-4,7,10,13,16,19,22-heptaone::CHEMBL2370516

SMILES [H][C@@]12CCCN1C(=O)[C@@H](Cc1c[nH]c3ccccc13)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](NC(=O)CNC2=O)C(C)C

InChI Key InChIKey=MRHAPHFJBAUDTR-UHFFFAOYSA-N

Data  2 KI

  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 = 50030098   

TargetSubstance-P receptor(Human)
Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL
LigandPNGBDBM50030098((R)-11-(4-Hydroxy-benzyl)-5-(1H-indol-3-ylmethyl)-...)
Affinity DataKi: >1.00E+5nMAssay Description:Displacement of [125I]- substance P binding to human astrocytoma cells (NK1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-K receptor(Human)
Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL
LigandPNGBDBM50030098((R)-11-(4-Hydroxy-benzyl)-5-(1H-indol-3-ylmethyl)-...)
Affinity DataKi: >1.00E+5nMAssay Description:Displacement of [125I]-NKA substance P binding to human urinary bladder membrane protein (NK2)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed