BindingDB logo
myBDB logout

BDBM50342773 CHEMBL457763::N-(2-(7-sulfamoylnaphthalen-1-yl)ethyl)acetamide::N-[2-(7-sulfamoyl-naphth-1-yl)ethyl]acetamide

SMILES: CC(=O)NCCc1cccc2ccc(cc12)S(N)(=O)=O

InChI Key: InChIKey=VUCSLISILBVLDV-UHFFFAOYSA-N

Data: 4 IC50

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 = 50342773   
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
Melatonin receptor


(Homo sapiens (Human))
BDBM50342773
PNG
(CHEMBL457763 | N-(2-(7-sulfamoylnaphthalen-1-yl)et...)
Show SMILES CC(=O)NCCc1cccc2ccc(cc12)S(N)(=O)=O
Show InChI InChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 310n/an/an/an/an/an/a



Univ Lille Nord de France

Curated by ChEMBL


Assay Description
Binding affinity to human MT1 receptor


Eur J Med Chem 46: 1622-9 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.010
BindingDB Entry DOI: 10.7270/Q2PZ594W
More data for this
Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone]


(Homo sapiens (Human))
BDBM50342773
PNG
(CHEMBL457763 | N-(2-(7-sulfamoylnaphthalen-1-yl)et...)
Show SMILES CC(=O)NCCc1cccc2ccc(cc12)S(N)(=O)=O
Show InChI InChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 32.4n/an/an/an/an/an/a



Lanzhou University

Curated by ChEMBL


Assay Description
Displacement of [125I]iodomelatonin from MT3/QR2 melatonin binding site expressed in CHO cells


Eur J Med Chem 43: 2861-9 (2008)


Article DOI: 10.1016/j.ejmech.2008.02.012
BindingDB Entry DOI: 10.7270/Q21C1Z31
More data for this
Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone]


(Homo sapiens (Human))
BDBM50342773
PNG
(CHEMBL457763 | N-(2-(7-sulfamoylnaphthalen-1-yl)et...)
Show SMILES CC(=O)NCCc1cccc2ccc(cc12)S(N)(=O)=O
Show InChI InChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Univ Lille Nord de France

Curated by ChEMBL


Assay Description
Binding affinity to human MT3 receptor


Eur J Med Chem 46: 1622-9 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.010
BindingDB Entry DOI: 10.7270/Q2PZ594W
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50342773
PNG
(CHEMBL457763 | N-(2-(7-sulfamoylnaphthalen-1-yl)et...)
Show SMILES CC(=O)NCCc1cccc2ccc(cc12)S(N)(=O)=O
Show InChI InChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 371n/an/an/an/an/an/a



Univ Lille Nord de France

Curated by ChEMBL


Assay Description
Binding affinity to human MT2 receptor


Eur J Med Chem 46: 1622-9 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.010
BindingDB Entry DOI: 10.7270/Q2PZ594W
More data for this
Ligand-Target Pair