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SMILES: COc1ccc(NCc2cnc[nH]2)c(c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1

InChI Key: InChIKey=ACSHHJKLILVPFO-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50171573   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50171573
PNG
(CHEMBL363169 | N-(1-Benzo[1,3]dioxol-5-ylmethyl-pi...)
Show SMILES COc1ccc(NCc2cnc[nH]2)c(c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1
Show InChI InChI=1S/C25H29N5O4/c1-32-20-3-4-22(27-13-19-12-26-15-28-19)21(11-20)25(31)29-18-6-8-30(9-7-18)14-17-2-5-23-24(10-17)34-16-33-23/h2-5,10-12,15,18,27H,6-9,13-14,16H2,1H3,(H,26,28)(H,29,31)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity towards melanin-concentrating hormone receptor 1 in IMR32 cells


Bioorg Med Chem Lett 15: 4174-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.089
BindingDB Entry DOI: 10.7270/Q2N29WGN
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50171573
PNG
(CHEMBL363169 | N-(1-Benzo[1,3]dioxol-5-ylmethyl-pi...)
Show SMILES COc1ccc(NCc2cnc[nH]2)c(c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1
Show InChI InChI=1S/C25H29N5O4/c1-32-20-3-4-22(27-13-19-12-26-15-28-19)21(11-20)25(31)29-18-6-8-30(9-7-18)14-17-2-5-23-24(10-17)34-16-33-23/h2-5,10-12,15,18,27H,6-9,13-14,16H2,1H3,(H,26,28)(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against MCH1R IMR32 cells in FLIPR-based assay


Bioorg Med Chem Lett 15: 4174-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.089
BindingDB Entry DOI: 10.7270/Q2N29WGN
More data for this
Ligand-Target Pair