BDBM50336914 3-[(21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.1^{5,8}.1^{10,13}.1^{15,18}.0^{2,6}]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]-N-(6-{[1-(2-iodophenyl)isoquinolin-3-yl]formamido}hexyl)propanamide::CHEMBL1672413

SMILES C=Cc1c(C)/c2[nH]/c1=C\c1[nH]c(c(CC)c1C)/C=c1\[nH]c3c(c1C)C(O)=CC=3c1[nH]c(c(C)c1CCC(=O)NCCCCCCNC(=O)c1cc3ccccc3c(-c3ccccc3I)n1)/C=2

InChI Key InChIKey=MKFYYJFWKGZMFJ-UHFFFAOYSA-N

Data  1 IC50  1 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 2 hits for monomerid = 50336914   

TargetTranslocator protein(Human)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50336914BDBM50336914(3-[(21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetra...)
Affinity DataKd:  40nMAssay Description:Binding affinity to PBRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2013
Entry Details Article
PubMed
TargetTranslocator protein(Human)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50336914BDBM50336914(3-[(21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetra...)
Affinity DataIC50: 310nMAssay Description:Displacement of [3H]-PK11195 from PBR after 1 hr by scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2013
Entry Details Article
PubMed