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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 949.1
BDBM50561609

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanocyte-stimulating hormone receptor


(Mus musculus)
BDBM50561609
PNG
(CHEMBL4753150)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)CN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)[C@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a


TBA

Assay Description
Agonist activity at mouse MC1R by alphascreen cAMP assay


Citation and Details

Article DOI: 10.1021/acsmedchemlett.9b00641
BindingDB Entry DOI: 10.7270/Q2VQ36C5
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50561609
PNG
(CHEMBL4753150)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)CN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)[C@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a


TBA

Assay Description
Agonist activity at mouse MC4R by alphascreen cAMP assay


Citation and Details

Article DOI: 10.1021/acsmedchemlett.9b00641
BindingDB Entry DOI: 10.7270/Q2VQ36C5
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50561609
PNG
(CHEMBL4753150)
Show SMILES [H][C@@]12CCCN1C(=O)[C@@]1([H])CCCN1C(=O)CN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)[C@H](CN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC2=O |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a


TBA

Assay Description
Agonist activity at mouse MC3R by alphascreen cAMP assay


Citation and Details

Article DOI: 10.1021/acsmedchemlett.9b00641
BindingDB Entry DOI: 10.7270/Q2VQ36C5
More data for this
Ligand-Target Pair