Found 8 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 |
|---|
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85855
(O-2094)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(O)c(Cl)c1 Show InChI InChI=1S/C27H38ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(31)29-23-24-20-21-26(30)25(28)22-24/h6-7,9-10,12-13,15-16,20-22,30H,2-5,8,11,14,17-19,23H2,1H3,(H,29,31)/b7-6-,10-9-,13-12-,16-15- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 274 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85856
(O-2142)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(OC(=O)CCCN2CCOCC2)c(OC)c1 Show InChI InChI=1S/C36H54N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-35(39)37-31-32-23-24-33(34(30-32)41-2)43-36(40)22-20-25-38-26-28-42-29-27-38/h7-8,10-11,13-14,16-17,23-24,30H,3-6,9,12,15,18-22,25-29,31H2,1-2H3,(H,37,39)/b8-7-,11-10-,14-13-,17-16- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 483 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85853
(O-1986)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1cccc(OC)c1 Show InChI InChI=1S/C28H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-28(30)29-25-26-21-20-22-27(24-26)31-2/h7-8,10-11,13-14,16-17,20-22,24H,3-6,9,12,15,18-19,23,25H2,1-2H3,(H,29,30)/b8-7-,11-10-,14-13-,17-16- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 484 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85857
(O-2093)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N(Cc1ccc(O)c(Cl)c1)Cc1ccc(O)c(Cl)c1 Show InChI InChI=1S/C34H43Cl2NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-34(40)37(26-28-20-22-32(38)30(35)24-28)27-29-21-23-33(39)31(36)25-29/h6-7,9-10,12-13,15-16,20-25,38-39H,2-5,8,11,14,17-19,26-27H2,1H3/b7-6-,10-9-,13-12-,16-15- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85854
(O-1987)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCNC(=O)NCc1ccc(O)c(OC)c1 Show InChI InChI=1S/C28H42N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-28(32)30-24-25-20-21-26(31)27(23-25)33-2/h7-8,10-11,13-14,16-17,20-21,23,31H,3-6,9,12,15,18-19,22,24H2,1-2H3,(H2,29,30,32)/b8-7-,11-10-,14-13-,17-16- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85851
(O-2109)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCNC(=S)NCc1ccc(O)c(Cl)c1 Show InChI InChI=1S/C27H39ClN2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-27(32)30-23-24-19-20-26(31)25(28)22-24/h6-7,9-10,12-13,15-16,19-20,22,31H,2-5,8,11,14,17-18,21,23H2,1H3,(H2,29,30,32)/b7-6-,10-9-,13-12-,16-15- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85858
(O-1988)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N(C)Cc1ccc(O)c(OC)c1 Show InChI InChI=1S/C29H43NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29(32)30(2)25-26-22-23-27(31)28(24-26)33-3/h8-9,11-12,14-15,17-18,22-24,31H,4-7,10,13,16,19-21,25H2,1-3H3/b9-8-,12-11-,15-14-,18-17- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 2.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Rattus norvegicus (rat)) | BDBM85852
(O-2095)Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCNC(=S)NCc1ccc(O)c(OC)c1 Show InChI InChI=1S/C28H42N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-28(33)30-24-25-20-21-26(31)27(23-25)32-2/h7-8,10-11,13-14,16-17,20-21,23,31H,3-6,9,12,15,18-19,22,24H2,1-2H3,(H2,29,30,33)/b8-7-,11-10-,14-13-,17-16- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 8.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Chimica Biomolecolare
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 300: 984-91 (2002)
Article DOI: 10.1124/jpet.300.3.984
BindingDB Entry DOI: 10.7270/Q24M9332 |
More data for this
Ligand-Target Pair | |
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