Found 5 hits Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM464662' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Nociceptin receptor
(Homo sapiens (Human)) | BDBM464662
(CIS-1-(Cyclopropyl-methyl)-8-dimethylamino-8-pheny...)Show SMILES CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)N3CCCS3(=O)=O)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.23,3.2,(5.39,-23.23,;3.85,-23.23,;3.08,-21.9,;3.08,-24.57,;2.31,-25.9,;.77,-25.9,;-0,-24.57,;-.91,-23.32,;-2.37,-23.8,;-3.71,-23.03,;-5.04,-23.8,;-5.81,-25.13,;-4.27,-25.13,;-6.37,-23.03,;-7.84,-23.5,;-8.74,-22.26,;-7.84,-21.01,;-6.37,-21.49,;-6.37,-19.95,;-4.89,-21.09,;-2.37,-25.34,;-3.62,-26.24,;-.91,-25.81,;-.43,-27.28,;-1.46,-28.42,;.03,-28.82,;-3,-28.42,;-3,-29.96,;-1.46,-29.96,;.77,-23.23,;2.31,-23.23,;3.85,-25.9,;3.08,-27.23,;3.85,-28.57,;5.39,-28.57,;6.16,-27.23,;5.39,-25.9,)| Show InChI InChI=1S/C28H44N4O4S/c1-25(2,32-18-9-19-37(32,35)36)20-30-21-26(31(24(30)33)22-27(34)12-8-13-27)14-16-28(17-15-26,29(3)4)23-10-6-5-7-11-23/h5-7,10-11,34H,8-9,12-22H2,1-4H3/t26-,28+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| 0.400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUENENTHAL GMBH
US Patent
| Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M... |
US Patent US10793556 (2020)
BindingDB Entry DOI: 10.7270/Q2XK8JMK |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM464662
(CIS-1-(Cyclopropyl-methyl)-8-dimethylamino-8-pheny...)Show SMILES CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)N3CCCS3(=O)=O)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.23,3.2,(5.39,-23.23,;3.85,-23.23,;3.08,-21.9,;3.08,-24.57,;2.31,-25.9,;.77,-25.9,;-0,-24.57,;-.91,-23.32,;-2.37,-23.8,;-3.71,-23.03,;-5.04,-23.8,;-5.81,-25.13,;-4.27,-25.13,;-6.37,-23.03,;-7.84,-23.5,;-8.74,-22.26,;-7.84,-21.01,;-6.37,-21.49,;-6.37,-19.95,;-4.89,-21.09,;-2.37,-25.34,;-3.62,-26.24,;-.91,-25.81,;-.43,-27.28,;-1.46,-28.42,;.03,-28.82,;-3,-28.42,;-3,-29.96,;-1.46,-29.96,;.77,-23.23,;2.31,-23.23,;3.85,-25.9,;3.08,-27.23,;3.85,-28.57,;5.39,-28.57,;6.16,-27.23,;5.39,-25.9,)| Show InChI InChI=1S/C28H44N4O4S/c1-25(2,32-18-9-19-37(32,35)36)20-30-21-26(31(24(30)33)22-27(34)12-8-13-27)14-16-28(17-15-26,29(3)4)23-10-6-5-7-11-23/h5-7,10-11,34H,8-9,12-22H2,1-4H3/t26-,28+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUENENTHAL GMBH
US Patent
| Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M... |
US Patent US10793556 (2020)
BindingDB Entry DOI: 10.7270/Q2XK8JMK |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM464662
(CIS-1-(Cyclopropyl-methyl)-8-dimethylamino-8-pheny...)Show SMILES CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)N3CCCS3(=O)=O)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.23,3.2,(5.39,-23.23,;3.85,-23.23,;3.08,-21.9,;3.08,-24.57,;2.31,-25.9,;.77,-25.9,;-0,-24.57,;-.91,-23.32,;-2.37,-23.8,;-3.71,-23.03,;-5.04,-23.8,;-5.81,-25.13,;-4.27,-25.13,;-6.37,-23.03,;-7.84,-23.5,;-8.74,-22.26,;-7.84,-21.01,;-6.37,-21.49,;-6.37,-19.95,;-4.89,-21.09,;-2.37,-25.34,;-3.62,-26.24,;-.91,-25.81,;-.43,-27.28,;-1.46,-28.42,;.03,-28.82,;-3,-28.42,;-3,-29.96,;-1.46,-29.96,;.77,-23.23,;2.31,-23.23,;3.85,-25.9,;3.08,-27.23,;3.85,-28.57,;5.39,-28.57,;6.16,-27.23,;5.39,-25.9,)| Show InChI InChI=1S/C28H44N4O4S/c1-25(2,32-18-9-19-37(32,35)36)20-30-21-26(31(24(30)33)22-27(34)12-8-13-27)14-16-28(17-15-26,29(3)4)23-10-6-5-7-11-23/h5-7,10-11,34H,8-9,12-22H2,1-4H3/t26-,28+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUENENTHAL GMBH
US Patent
| Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M... |
US Patent US10793556 (2020)
BindingDB Entry DOI: 10.7270/Q2XK8JMK |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM464662
(CIS-1-(Cyclopropyl-methyl)-8-dimethylamino-8-pheny...)Show SMILES CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)N3CCCS3(=O)=O)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.23,3.2,(5.39,-23.23,;3.85,-23.23,;3.08,-21.9,;3.08,-24.57,;2.31,-25.9,;.77,-25.9,;-0,-24.57,;-.91,-23.32,;-2.37,-23.8,;-3.71,-23.03,;-5.04,-23.8,;-5.81,-25.13,;-4.27,-25.13,;-6.37,-23.03,;-7.84,-23.5,;-8.74,-22.26,;-7.84,-21.01,;-6.37,-21.49,;-6.37,-19.95,;-4.89,-21.09,;-2.37,-25.34,;-3.62,-26.24,;-.91,-25.81,;-.43,-27.28,;-1.46,-28.42,;.03,-28.82,;-3,-28.42,;-3,-29.96,;-1.46,-29.96,;.77,-23.23,;2.31,-23.23,;3.85,-25.9,;3.08,-27.23,;3.85,-28.57,;5.39,-28.57,;6.16,-27.23,;5.39,-25.9,)| Show InChI InChI=1S/C28H44N4O4S/c1-25(2,32-18-9-19-37(32,35)36)20-30-21-26(31(24(30)33)22-27(34)12-8-13-27)14-16-28(17-15-26,29(3)4)23-10-6-5-7-11-23/h5-7,10-11,34H,8-9,12-22H2,1-4H3/t26-,28+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUENENTHAL GMBH
US Patent
| Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M... |
US Patent US10793556 (2020)
BindingDB Entry DOI: 10.7270/Q2XK8JMK |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM464662
(CIS-1-(Cyclopropyl-methyl)-8-dimethylamino-8-pheny...)Show SMILES CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)N3CCCS3(=O)=O)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.23,3.2,(5.39,-23.23,;3.85,-23.23,;3.08,-21.9,;3.08,-24.57,;2.31,-25.9,;.77,-25.9,;-0,-24.57,;-.91,-23.32,;-2.37,-23.8,;-3.71,-23.03,;-5.04,-23.8,;-5.81,-25.13,;-4.27,-25.13,;-6.37,-23.03,;-7.84,-23.5,;-8.74,-22.26,;-7.84,-21.01,;-6.37,-21.49,;-6.37,-19.95,;-4.89,-21.09,;-2.37,-25.34,;-3.62,-26.24,;-.91,-25.81,;-.43,-27.28,;-1.46,-28.42,;.03,-28.82,;-3,-28.42,;-3,-29.96,;-1.46,-29.96,;.77,-23.23,;2.31,-23.23,;3.85,-25.9,;3.08,-27.23,;3.85,-28.57,;5.39,-28.57,;6.16,-27.23,;5.39,-25.9,)| Show InChI InChI=1S/C28H44N4O4S/c1-25(2,32-18-9-19-37(32,35)36)20-30-21-26(31(24(30)33)22-27(34)12-8-13-27)14-16-28(17-15-26,29(3)4)23-10-6-5-7-11-23/h5-7,10-11,34H,8-9,12-22H2,1-4H3/t26-,28+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| 64 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUENENTHAL GMBH
US Patent
| Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M... |
US Patent US10793556 (2020)
BindingDB Entry DOI: 10.7270/Q2XK8JMK |
More data for this
Ligand-Target Pair | |
Search and Browse
