BDBM50342036 2-((2S)-2-((2S)-1-((4R,7S,10S,13S,16S)-7-(2-amino-2-oxoethyl)-13-benzyl-19-hydroxy-16-(4-hydroxybenzyl)-10-isobutyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)pyrrolidine-2-carboxamido)-6-(11-aminoundecanamido)hexanamido)acetic acid::CHEMBL1765671

SMILES CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(O)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCNC(=O)CCCCCCCCCCN)C(=O)NCC(O)=O

InChI Key InChIKey=PTZRRMMUCKNVAP-CNPIYYERSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50342036   

TargetVasopressin V1b receptor(Homo sapiens (Human))
University Of Montpellier

Curated by ChEMBL
LigandPNGBDBM50342036(2-((2S)-2-((2S)-1-((4R,7S,10S,13S,16S)-7-(2-amino-...)
Affinity DataKi:  8.40nMAssay Description:Displacement of [3H]AVP from human vasopressin V1b receptor expressed CHO cells after 60 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V1a receptor(Homo sapiens (Human))
University Of Montpellier

Curated by ChEMBL
LigandPNGBDBM50342036(2-((2S)-2-((2S)-1-((4R,7S,10S,13S,16S)-7-(2-amino-...)
Affinity DataKi:  2.79E+3nMAssay Description:Displacement of [3H]AVP from human vasopressin V1a receptor expressed CHO cells after 60 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOxytocin receptor(Homo sapiens (Human))
University Of Montpellier

Curated by ChEMBL
LigandPNGBDBM50342036(2-((2S)-2-((2S)-1-((4R,7S,10S,13S,16S)-7-(2-amino-...)
Affinity DataKi:  3.74E+3nMAssay Description:Displacement of [3H]AVP from human oxytocin receptor expressed CHO cells after 60 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V2 receptor(Homo sapiens (Human))
University Of Montpellier

Curated by ChEMBL
LigandPNGBDBM50342036(2-((2S)-2-((2S)-1-((4R,7S,10S,13S,16S)-7-(2-amino-...)
Affinity DataKi:  4.50E+4nMAssay Description:Displacement of [3H]AVP from human vasopressin V2 receptor expressed CHO cells after 60 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed