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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
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Ki
IC50
Kd
EC50
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Found
3
hits of ic50 for monomerid = 50159238
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Melanin-concentrating hormone receptor 1
(Mus musculus)
BDBM50159238
(CHEMBL3786272)
Show SMILES
COc1ccc(cc1)-c1nnc(o1)C(=O)N1CC(C1)Oc1ccc(CN(C)C)c(C)c1
Show InChI
InChI=1S/C23H26N4O4/c1-15-11-19(10-7-17(15)12-26(2)3)30-20-13-27(14-20)23(28)22-25-24-21(31-22)16-5-8-18(29-4)9-6-16/h5-11,20H,12-14H2,1-4H3
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
n/a
n/a
14
n/a
n/a
n/a
n/a
n/a
n/a
AstraZeneca
Curated by
ChEMBL
Assay Description
Displacement of [125I]Tyr13-MCH from mouse MCHR1 after 60 mins by microbeta scintillation counting analysis
J Med Chem
59:
2497
-
511
(2016)
Article DOI:
10.1021/acs.jmedchem.5b01654
BindingDB Entry DOI:
10.7270/Q23R0VSS
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1
(Homo sapiens (Human))
BDBM50159238
(CHEMBL3786272)
Show SMILES
COc1ccc(cc1)-c1nnc(o1)C(=O)N1CC(C1)Oc1ccc(CN(C)C)c(C)c1
Show InChI
InChI=1S/C23H26N4O4/c1-15-11-19(10-7-17(15)12-26(2)3)30-20-13-27(14-20)23(28)22-25-24-21(31-22)16-5-8-18(29-4)9-6-16/h5-11,20H,12-14H2,1-4H3
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
n/a
n/a
23
n/a
n/a
n/a
n/a
n/a
n/a
AstraZeneca
Curated by
ChEMBL
Assay Description
Antagonist activity at human MCHR1 expressed in CHO cell membranes preincubated for 5 mins followed by addition of MCH peptide measured after 45 mins...
J Med Chem
59:
2497
-
511
(2016)
Article DOI:
10.1021/acs.jmedchem.5b01654
BindingDB Entry DOI:
10.7270/Q23R0VSS
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
BDBM50159238
(CHEMBL3786272)
Show SMILES
COc1ccc(cc1)-c1nnc(o1)C(=O)N1CC(C1)Oc1ccc(CN(C)C)c(C)c1
Show InChI
InChI=1S/C23H26N4O4/c1-15-11-19(10-7-17(15)12-26(2)3)30-20-13-27(14-20)23(28)22-25-24-21(31-22)16-5-8-18(29-4)9-6-16/h5-11,20H,12-14H2,1-4H3
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
n/a
n/a
1.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
AstraZeneca
Curated by
ChEMBL
Assay Description
Inhibition of human ERG by IonWork assay
J Med Chem
59:
2497
-
511
(2016)
Article DOI:
10.1021/acs.jmedchem.5b01654
BindingDB Entry DOI:
10.7270/Q23R0VSS
More data for this
Ligand-Target Pair