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BDBM50111173 6-(3-Naphthalen-2-ylmethyl-3-naphthalen-1-ylmethyl-ureido)-hexanoic acid::CHEMBL8825

SMILES: OC(=O)CCCCCNC(=O)N(Cc1ccc2ccccc2c1)Cc1cccc2ccccc12

InChI Key: InChIKey=AIQVHEKDZNMUKX-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50111173   
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
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))
BDBM50111173
PNG
(6-(3-Naphthalen-2-ylmethyl-3-naphthalen-1-ylmethyl...)
Show SMILES OC(=O)CCCCCNC(=O)N(Cc1ccc2ccccc2c1)Cc1cccc2ccccc12
Show InChI InChI=1S/C29H30N2O3/c32-28(33)15-2-1-7-18-30-29(34)31(20-22-16-17-23-9-3-4-11-25(23)19-22)21-26-13-8-12-24-10-5-6-14-27(24)26/h3-6,8-14,16-17,19H,1-2,7,15,18,20-21H2,(H,30,34)(H,32,33)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.50E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Tested for its binding affinity towards human recombinant Melanocortin 1 receptor by using radioligand binding assay


Bioorg Med Chem Lett 12: 1035-8 (2002)


BindingDB Entry DOI: 10.7270/Q2D799RR
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50111173
PNG
(6-(3-Naphthalen-2-ylmethyl-3-naphthalen-1-ylmethyl...)
Show SMILES OC(=O)CCCCCNC(=O)N(Cc1ccc2ccccc2c1)Cc1cccc2ccccc12
Show InChI InChI=1S/C29H30N2O3/c32-28(33)15-2-1-7-18-30-29(34)31(20-22-16-17-23-9-3-4-11-25(23)19-22)21-26-13-8-12-24-10-5-6-14-27(24)26/h3-6,8-14,16-17,19H,1-2,7,15,18,20-21H2,(H,30,34)(H,32,33)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.00E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Tested for its binding affinity towards human recombinant Melanocortin 4 receptor by using radioligand binding assay


Bioorg Med Chem Lett 12: 1035-8 (2002)


BindingDB Entry DOI: 10.7270/Q2D799RR
More data for this
Ligand-Target Pair
Melanocortin receptor 5 (MC5R)


(Homo sapiens (Human))
BDBM50111173
PNG
(6-(3-Naphthalen-2-ylmethyl-3-naphthalen-1-ylmethyl...)
Show SMILES OC(=O)CCCCCNC(=O)N(Cc1ccc2ccccc2c1)Cc1cccc2ccccc12
Show InChI InChI=1S/C29H30N2O3/c32-28(33)15-2-1-7-18-30-29(34)31(20-22-16-17-23-9-3-4-11-25(23)19-22)21-26-13-8-12-24-10-5-6-14-27(24)26/h3-6,8-14,16-17,19H,1-2,7,15,18,20-21H2,(H,30,34)(H,32,33)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
4.10E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Tested for its binding affinity towards human recombinant Melanocortin 5 receptor by using radioligand binding assay


Bioorg Med Chem Lett 12: 1035-8 (2002)


BindingDB Entry DOI: 10.7270/Q2D799RR
More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50111173
PNG
(6-(3-Naphthalen-2-ylmethyl-3-naphthalen-1-ylmethyl...)
Show SMILES OC(=O)CCCCCNC(=O)N(Cc1ccc2ccccc2c1)Cc1cccc2ccccc12
Show InChI InChI=1S/C29H30N2O3/c32-28(33)15-2-1-7-18-30-29(34)31(20-22-16-17-23-9-3-4-11-25(23)19-22)21-26-13-8-12-24-10-5-6-14-27(24)26/h3-6,8-14,16-17,19H,1-2,7,15,18,20-21H2,(H,30,34)(H,32,33)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.30E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Tested for its binding affinity towards human recombinant Melanocortin 3 receptor by using radioligand binding assay


Bioorg Med Chem Lett 12: 1035-8 (2002)


BindingDB Entry DOI: 10.7270/Q2D799RR
More data for this
Ligand-Target Pair