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SMILES: N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1

InChI Key: InChIKey=VADQRJNCGGKONM-OAQYLSRUSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50372555   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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PubMed
23n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
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PubMed
2.30E+3n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
PDB

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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Displacement of europium labeled NDP-alpha-MSH from human MC1 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
PDB

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n/an/an/an/a 16n/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Agonist activity at human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 230n/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Agonist activity at human MC3 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50372555
PNG
(CHEMBL272099)
Show SMILES N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(Cn2cncn2)(CC1)C1CCCCC1
Show InChI InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)14-21(25)22(30)28-12-10-23(11-13-28,15-29-17-26-16-27-29)19-4-2-1-3-5-19/h6-9,16-17,19,21H,1-5,10-15,25H2/t21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



Nanyang Technological University

Curated by ChEMBL


Assay Description
Agonist activity at human MC1 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1223-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.109
BindingDB Entry DOI: 10.7270/Q2TM7BZM
More data for this
Ligand-Target Pair