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SMILES: [H][C@]12CC[C@]([H])(C[C@](C1)(C(N)=O)c1ccc(OC)cn1)N2C(c1ccccc1Cl)c1ccccc1Cl

InChI Key: InChIKey=HFFONOLSXMZIJR-QZTJIDSGSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50259186   
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
Nociceptin receptor


(Homo sapiens (Human))
BDBM50259186
PNG
(CHEMBL3084533 | endo-8-(bis(2-chlorophenyl)methyl)...)
Show SMILES [H][C@]12CC[C@]([H])(C[C@](C1)(C(N)=O)c1ccc(OC)cn1)N2C(c1ccccc1Cl)c1ccccc1Cl |r,TLB:9:7:20:3.2|
Show InChI InChI=1S/C27H27Cl2N3O2/c1-34-19-12-13-24(31-16-19)27(26(30)33)14-17-10-11-18(15-27)32(17)25(20-6-2-4-8-22(20)28)21-7-3-5-9-23(21)29/h2-9,12-13,16-18,25H,10-11,14-15H2,1H3,(H2,30,33)/t17-,18-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
22n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I][Tyr14]nociceptin from human cloned ORL1 receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 2482-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.057
BindingDB Entry DOI: 10.7270/Q2D21XH9
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50259186
PNG
(CHEMBL3084533 | endo-8-(bis(2-chlorophenyl)methyl)...)
Show SMILES [H][C@]12CC[C@]([H])(C[C@](C1)(C(N)=O)c1ccc(OC)cn1)N2C(c1ccccc1Cl)c1ccccc1Cl |r,TLB:9:7:20:3.2|
Show InChI InChI=1S/C27H27Cl2N3O2/c1-34-19-12-13-24(31-16-19)27(26(30)33)14-17-10-11-18(15-27)32(17)25(20-6-2-4-8-22(20)28)21-7-3-5-9-23(21)29/h2-9,12-13,16-18,25H,10-11,14-15H2,1H3,(H2,30,33)/t17-,18-/m1/s1
PDB

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Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
133n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human mu opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 2482-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.057
BindingDB Entry DOI: 10.7270/Q2D21XH9
More data for this
Ligand-Target Pair