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SMILES: CN(C)C(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1(CCCCC1)Oc1cc(C)ccc1Cl

InChI Key: InChIKey=LQXZWLDWDGUVKO-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50159927   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159927
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES CN(C)C(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1(CCCCC1)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C29H39ClN4O2/c1-21-11-12-23(30)26(19-21)36-29(15-7-4-8-16-29)27(32(2)3)20-33-17-13-22(14-18-33)34-25-10-6-5-9-24(25)31-28(34)35/h5-6,9-12,19,22,27H,4,7-8,13-18,20H2,1-3H3,(H,31,35)
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PC cid
PC sid
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Similars

Article
PubMed
102n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159927
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES CN(C)C(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1(CCCCC1)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C29H39ClN4O2/c1-21-11-12-23(30)26(19-21)36-29(15-7-4-8-16-29)27(32(2)3)20-33-17-13-22(14-18-33)34-25-10-6-5-9-24(25)31-28(34)35/h5-6,9-12,19,22,27H,4,7-8,13-18,20H2,1-3H3,(H,31,35)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
815n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair