BDBM50339346 (R)-trans-(2S,5S,8S,11S,14R,19R,22S,25R,28R,31S)-22-((1H-imidazol-5-yl)methyl)-2-((1H-indol-3-yl)methyl)-5-(2-amino-2-oxoethyl)-N-((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)-19-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)-11,25-dibenzyl-31-(3-guanidinopropyl)-8-methyl-3,6,9,12,20,23,26,29,33-nonaoxo-16,17,35-trithia-1,4,7,10,13,21,24,27,30-nonaazabicyclo[26.4.4]hexatriacontane-14-carboxamide::CHEMBL1688110

SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N2C[C@H](CCCN=C(N)N)NC(=O)[C@H](CSCC2=O)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1

InChI Key InChIKey=SAUMKWJPJZDAEN-UHFFFAOYSA-N

Data  4 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50339346   

TargetMelanocortin receptor 4(Mouse)
University of Florida

Curated by ChEMBL
LigandPNGBDBM50339346((R)-trans-(2S,5S,8S,11S,14R,19R,22S,25R,28R,31S)-2...)
Affinity DataEC50:  85nMAssay Description:Agonist activity at mouse melanocortin 4 receptor expressed in HEK293 cells after 48 hrs by cAMP based beta-galactosidase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetMelanocyte-stimulating hormone receptor(Mouse)
University of Florida

Curated by ChEMBL
LigandPNGBDBM50339346((R)-trans-(2S,5S,8S,11S,14R,19R,22S,25R,28R,31S)-2...)
Affinity DataEC50:  33nMAssay Description:Agonist activity at mouse melanocortin 1 receptor expressed in HEK293 cells after 48 hrs by cAMP based beta-galactosidase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetMelanocortin receptor 5(Mouse)
University of Florida

Curated by ChEMBL
LigandPNGBDBM50339346((R)-trans-(2S,5S,8S,11S,14R,19R,22S,25R,28R,31S)-2...)
Affinity DataEC50:  72nMAssay Description:Agonist activity at mouse melanocortin 5 receptor expressed in HEK293 cells after 48 hrs by cAMP based beta-galactosidase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetMelanocortin receptor 3(Mouse)
University of Florida

Curated by ChEMBL
LigandPNGBDBM50339346((R)-trans-(2S,5S,8S,11S,14R,19R,22S,25R,28R,31S)-2...)
Affinity DataEC50:  495nMAssay Description:Agonist activity at mouse melanocortin 3 receptor expressed in HEK293 cells after 48 hrs by cAMP based beta-galactosidase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed