Found 16 hits of Enzyme Inhibition Constant Data 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 |
|---|
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223497
(CHEMBL26232)Show SMILES Cl.[#6]-[#6]-[#6]1-[#6]-2-[#6]-c3ccc(-[#8])cc3C1([#6]-[#6])[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C22H35N5O2.ClH/c1-3-16-19-12-14-7-8-15(28)13-17(14)22(16,4-2)9-11-27(19)20(29)18(23)6-5-10-26-21(24)25;/h7-8,13,16,18-19,28H,3-6,9-12,23H2,1-2H3,(H4,24,25,26);1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50019056
((S)-2-[(S)-2-(2-{2-[(S)-2-Amino-3-(4-hydroxy-pheny...)Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C27H35N5O7S/c1-40-12-11-21(27(38)39)32-26(37)22(14-17-5-3-2-4-6-17)31-24(35)16-29-23(34)15-30-25(36)20(28)13-18-7-9-19(33)10-8-18/h2-10,20-22,33H,11-16,28H2,1H3,(H,29,34)(H,30,36)(H,31,35)(H,32,37)(H,38,39)/t20-,21-,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223493
(CHEMBL24175)Show SMILES [H][C@]12Cc3ccc(O)cc3[C@](CC)(CCN1)[C@@]2([H])CC |THB:18:16:9.3.2:15.13.14| Show InChI InChI=1S/C16H23NO/c1-3-13-15-9-11-5-6-12(18)10-14(11)16(13,4-2)7-8-17-15/h5-6,10,13,15,17-18H,3-4,7-9H2,1-2H3/t13-,15+,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]- naloxone] from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50019056
((S)-2-[(S)-2-(2-{2-[(S)-2-Amino-3-(4-hydroxy-pheny...)Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C27H35N5O7S/c1-40-12-11-21(27(38)39)32-26(37)22(14-17-5-3-2-4-6-17)31-24(35)16-29-23(34)15-30-25(36)20(28)13-18-7-9-19(33)10-8-18/h2-10,20-22,33H,11-16,28H2,1H3,(H,29,34)(H,30,36)(H,31,35)(H,32,37)(H,38,39)/t20-,21-,22-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223498
(CHEMBL286206)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)CN |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C18H26N2O2.ClH/c1-3-14-16-9-12-5-6-13(21)10-15(12)18(14,4-2)7-8-20(16)17(22)11-19;/h5-6,10,14,16,21H,3-4,7-9,11,19H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 287 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223496
(CHEMBL282347)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)CCSC |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C21H32N2O2S.ClH/c1-4-16-19-12-14-6-7-15(24)13-17(14)21(16,5-2)9-10-23(19)20(25)18(22)8-11-26-3;/h6-7,13,16,18-19,24H,4-5,8-12,22H2,1-3H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 301 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223493
(CHEMBL24175)Show SMILES [H][C@]12Cc3ccc(O)cc3[C@](CC)(CCN1)[C@@]2([H])CC |THB:18:16:9.3.2:15.13.14| Show InChI InChI=1S/C16H23NO/c1-3-13-15-9-11-5-6-12(18)10-14(11)16(13,4-2)7-8-17-15/h5-6,10,13,15,17-18H,3-4,7-9H2,1-2H3/t13-,15+,16+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]- naloxone] from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223497
(CHEMBL26232)Show SMILES Cl.[#6]-[#6]-[#6]1-[#6]-2-[#6]-c3ccc(-[#8])cc3C1([#6]-[#6])[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C22H35N5O2.ClH/c1-3-16-19-12-14-7-8-15(28)13-17(14)22(16,4-2)9-11-27(19)20(29)18(23)6-5-10-26-21(24)25;/h7-8,13,16,18-19,28H,3-6,9-12,23H2,1-2H3,(H4,24,25,26);1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223494
(CHEMBL1159833)Show SMILES CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)CC(C)C |TLB:10:11:2:17.16.15| Show InChI InChI=1S/C22H34N2O2/c1-5-17-20-12-15-7-8-16(25)13-18(15)22(17,6-2)9-10-24(20)21(26)19(23)11-14(3)4/h7-8,13-14,17,19-20,25H,5-6,9-12,23H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223495
(CHEMBL25778)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)Cc1ccccc1 |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C25H32N2O2.ClH/c1-3-20-23-15-18-10-11-19(28)16-21(18)25(20,4-2)12-13-27(23)24(29)22(26)14-17-8-6-5-7-9-17;/h5-11,16,20,22-23,28H,3-4,12-15,26H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223495
(CHEMBL25778)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)Cc1ccccc1 |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C25H32N2O2.ClH/c1-3-20-23-15-18-10-11-19(28)16-21(18)25(20,4-2)12-13-27(23)24(29)22(26)14-17-8-6-5-7-9-17;/h5-11,16,20,22-23,28H,3-4,12-15,26H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.35E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223496
(CHEMBL282347)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)CCSC |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C21H32N2O2S.ClH/c1-4-16-19-12-14-6-7-15(24)13-17(14)21(16,5-2)9-10-23(19)20(25)18(22)8-11-26-3;/h6-7,13,16,18-19,24H,4-5,8-12,22H2,1-3H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223494
(CHEMBL1159833)Show SMILES CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)CC(C)C |TLB:10:11:2:17.16.15| Show InChI InChI=1S/C22H34N2O2/c1-5-17-20-12-15-7-8-16(25)13-18(15)22(17,6-2)9-10-24(20)21(26)19(23)11-14(3)4/h7-8,13-14,17,19-20,25H,5-6,9-12,23H2,1-4H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223498
(CHEMBL286206)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)CN |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C18H26N2O2.ClH/c1-3-14-16-9-12-5-6-13(21)10-15(12)18(14,4-2)7-8-20(16)17(22)11-19;/h5-6,10,14,16,21H,3-4,7-9,11,19H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 8.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223495
(CHEMBL25778)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)Cc1ccccc1 |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C25H32N2O2.ClH/c1-3-20-23-15-18-10-11-19(28)16-21(18)25(20,4-2)12-13-27(23)24(29)22(26)14-17-8-6-5-7-9-17;/h5-11,16,20,22-23,28H,3-4,12-15,26H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in presence of NaCl (100 mM) |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1
(Rattus norvegicus (rat)-RAT) | BDBM50223495
(CHEMBL25778)Show SMILES Cl.CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)Cc1ccccc1 |TLB:11:12:3:18.17.16| Show InChI InChI=1S/C25H32N2O2.ClH/c1-3-20-23-15-18-10-11-19(28)16-21(18)25(20,4-2)12-13-27(23)24(29)22(26)14-17-8-6-5-7-9-17;/h5-11,16,20,22-23,28H,3-4,12-15,26H2,1-2H3;1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Compound was tested for its ability to displace [3H]naloxone from Opioid receptors in absence of NaCl |
J Med Chem 24: 1297-9 (1981)
BindingDB Entry DOI: 10.7270/Q20C4XZN |
More data for this
Ligand-Target Pair | |
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