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Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50200588   
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
Nociceptin receptor


(Homo sapiens (Human))
BDBM50200588
PNG
((3-{1-[3-(5-methoxy-2-methyl-phenoxy)-4-methylpent...)
Show SMILES COC(=O)Cn1c2ccccc2n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c1=O |w:19.20|
Show InChI InChI=1S/C29H39N3O5/c1-20(2)26(37-27-18-23(35-4)11-10-21(27)3)14-17-30-15-12-22(13-16-30)32-25-9-7-6-8-24(25)31(29(32)34)19-28(33)36-5/h6-11,18,20,22,26H,12-17,19H2,1-5H3
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4n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cells


Bioorg Med Chem 15: 1828-47 (2007)


Article DOI: 10.1016/j.bmc.2006.11.030
BindingDB Entry DOI: 10.7270/Q27S7NF2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50200588
PNG
((3-{1-[3-(5-methoxy-2-methyl-phenoxy)-4-methylpent...)
Show SMILES COC(=O)Cn1c2ccccc2n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c1=O |w:19.20|
Show InChI InChI=1S/C29H39N3O5/c1-20(2)26(37-27-18-23(35-4)11-10-21(27)3)14-17-30-15-12-22(13-16-30)32-25-9-7-6-8-24(25)31(29(32)34)19-28(33)36-5/h6-11,18,20,22,26H,12-17,19H2,1-5H3
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271n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human MOP receptor expressed in CHOK1 cells


Bioorg Med Chem 15: 1828-47 (2007)


Article DOI: 10.1016/j.bmc.2006.11.030
BindingDB Entry DOI: 10.7270/Q27S7NF2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50200588
PNG
((3-{1-[3-(5-methoxy-2-methyl-phenoxy)-4-methylpent...)
Show SMILES COC(=O)Cn1c2ccccc2n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c1=O |w:19.20|
Show InChI InChI=1S/C29H39N3O5/c1-20(2)26(37-27-18-23(35-4)11-10-21(27)3)14-17-30-15-12-22(13-16-30)32-25-9-7-6-8-24(25)31(29(32)34)19-28(33)36-5/h6-11,18,20,22,26H,12-17,19H2,1-5H3
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671n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from KOP receptor in guinea pig cortical tissue


Bioorg Med Chem 15: 1828-47 (2007)


Article DOI: 10.1016/j.bmc.2006.11.030
BindingDB Entry DOI: 10.7270/Q27S7NF2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50200588
PNG
((3-{1-[3-(5-methoxy-2-methyl-phenoxy)-4-methylpent...)
Show SMILES COC(=O)Cn1c2ccccc2n(C2CCN(CCC(Oc3cc(OC)ccc3C)C(C)C)CC2)c1=O |w:19.20|
Show InChI InChI=1S/C29H39N3O5/c1-20(2)26(37-27-18-23(35-4)11-10-21(27)3)14-17-30-15-12-22(13-16-30)32-25-9-7-6-8-24(25)31(29(32)34)19-28(33)36-5/h6-11,18,20,22,26H,12-17,19H2,1-5H3
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3.08E+3n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]naltrindole from human DOP receptor expressed in deltaC6 cells


Bioorg Med Chem 15: 1828-47 (2007)


Article DOI: 10.1016/j.bmc.2006.11.030
BindingDB Entry DOI: 10.7270/Q27S7NF2
More data for this
Ligand-Target Pair