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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50188396   
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
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM50188396
PNG
(CHEMBL206419 | N-(2-[5-methoxy-1-methyl-1H-indol-3...)
Show SMILES CCCC(=O)NCC1(CCCC1)c1cn(C)c2ccc(OC)cc12
Show InChI InChI=1S/C20H28N2O2/c1-4-7-19(23)21-14-20(10-5-6-11-20)17-13-22(2)18-9-8-15(24-3)12-16(17)18/h8-9,12-13H,4-7,10-11,14H2,1-3H3,(H,21,23)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
85.1n/an/an/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human recombinant MT2 receptor expressed in NIH3T3 cells


J Med Chem 49: 3509-19 (2006)


Article DOI: 10.1021/jm0512544
BindingDB Entry DOI: 10.7270/Q2JW8DJQ
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM50188396
PNG
(CHEMBL206419 | N-(2-[5-methoxy-1-methyl-1H-indol-3...)
Show SMILES CCCC(=O)NCC1(CCCC1)c1cn(C)c2ccc(OC)cc12
Show InChI InChI=1S/C20H28N2O2/c1-4-7-19(23)21-14-20(10-5-6-11-20)17-13-22(2)18-9-8-15(24-3)12-16(17)18/h8-9,12-13H,4-7,10-11,14H2,1-3H3,(H,21,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
589n/an/an/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human recombinant MT1 receptor expressed in NIH3T3 cells


J Med Chem 49: 3509-19 (2006)


Article DOI: 10.1021/jm0512544
BindingDB Entry DOI: 10.7270/Q2JW8DJQ
More data for this
Ligand-Target Pair