Found 13 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 2
(Homo sapiens (Human)) | BDBM93025
(CB2 Inhibitor, 1)Show SMILES CCCCCC(C)C(C)c1cc(O)c2C3=C(CCN(C3)C#C)C(C)(C)Oc2c1 |t:14| Show InChI InChI=1S/C25H35NO2/c1-7-9-10-11-17(3)18(4)19-14-22(27)24-20-16-26(8-2)13-12-21(20)25(5,6)28-23(24)15-19/h2,14-15,17-18,27H,7,9-13,16H2,1,3-6H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93026
(CB2 Inhibitor, 2)Show SMILES Cc1nn(Cc2ccc(F)cc2)c2sc(cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O Show InChI InChI=1S/C22H21FN4O2S/c1-12-8-13(2)25-20(28)18(12)10-24-21(29)19-9-17-14(3)26-27(22(17)30-19)11-15-4-6-16(23)7-5-15/h4-9H,10-11H2,1-3H3,(H,24,29)(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 143 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93027
(CB2 Inhibitor, 3)Show SMILES CC1N(C)c2ccc(cc2C1(C)C)P(=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C24H26NOP/c1-18-24(2,3)22-17-21(15-16-23(22)25(18)4)27(26,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-18H,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 540 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93028
(CB2 Inhibitor, 4)Show SMILES Cc1cc(C(=O)COc2ccccc2C(N)=O)c(C)n1CCC1=CCCCC1 |t:24| Show InChI InChI=1S/C23H28N2O3/c1-16-14-20(17(2)25(16)13-12-18-8-4-3-5-9-18)21(26)15-28-22-11-7-6-10-19(22)23(24)27/h6-8,10-11,14H,3-5,9,12-13,15H2,1-2H3,(H2,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 960 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93029
(CB2 Inhibitor, 5)Show InChI InChI=1S/C24H28N2O2/c1-16-7-9-20-19(13-16)18-5-3-6-21-24(18)26(20)12-4-11-25(21)15-17-8-10-23(28-2)22(27)14-17/h7-10,13-14,21,27H,3-6,11-12,15H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93030
(CB2 Inhibitor, 6)Show SMILES CC1CCCN(Cc2cc(ccc2OCC(=O)NCc2ccccc2F)-c2ccc3OCOc3c2)C1 Show InChI InChI=1S/C29H31FN2O4/c1-20-5-4-12-32(16-20)17-24-13-21(22-9-11-27-28(14-22)36-19-35-27)8-10-26(24)34-18-29(33)31-15-23-6-2-3-7-25(23)30/h2-3,6-11,13-14,20H,4-5,12,15-19H2,1H3,(H,31,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 4.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93031
(CB2 Inhibitor, 7)Show SMILES C(N1CCCCC1)c1nc(NC2CCCc3ccccc23)c2c3CCCCc3sc2n1 Show InChI InChI=1S/C26H32N4S/c1-6-15-30(16-7-1)17-23-28-25(24-20-12-4-5-14-22(20)31-26(24)29-23)27-21-13-8-10-18-9-2-3-11-19(18)21/h2-3,9,11,21H,1,4-8,10,12-17H2,(H,27,28,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93032
(CB2 Inhibitor, 8)Show SMILES O=C(CCC(=O)c1ccc2CCCCc2c1)N1CCC(CC1)n1c2ccccc2[nH]c1=O Show InChI InChI=1S/C26H29N3O3/c30-24(20-10-9-18-5-1-2-6-19(18)17-20)11-12-25(31)28-15-13-21(14-16-28)29-23-8-4-3-7-22(23)27-26(29)32/h3-4,7-10,17,21H,1-2,5-6,11-16H2,(H,27,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 8.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93033
(CB2 Inhibitor, 9)Show SMILES CCC(CC)S(=O)(=O)c1cccc(c1)-c1nnc(SCCN(C)C)n1C1CCCCCC1 Show InChI InChI=1S/C24H38N4O2S2/c1-5-21(6-2)32(29,30)22-15-11-12-19(18-22)23-25-26-24(31-17-16-27(3)4)28(23)20-13-9-7-8-10-14-20/h11-12,15,18,20-21H,5-10,13-14,16-17H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 9.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93034
(CB2 Inhibitor, 10)Show SMILES CCCC(=NNC(=O)C1CC1(c1cccc(C)c1)c1cccc(C)c1)c1ccc(OC)cc1 |w:4.4| Show InChI InChI=1S/C29H32N2O2/c1-5-8-27(22-13-15-25(33-4)16-14-22)30-31-28(32)26-19-29(26,23-11-6-9-20(2)17-23)24-12-7-10-21(3)18-24/h6-7,9-18,26H,5,8,19H2,1-4H3,(H,31,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 1.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93035
(CB2 Inhibitor, 11)Show SMILES CC1=CC(C(=O)CN2C(=O)NC(C)(C2=O)c2ccc(F)cc2)=C(C)C1CCc1cccs1 |t:1,23| Show InChI InChI=1S/C25H25FN2O3S/c1-15-13-21(16(2)20(15)11-10-19-5-4-12-32-19)22(29)14-28-23(30)25(3,27-24(28)31)17-6-8-18(26)9-7-17/h4-9,12-13,20H,10-11,14H2,1-3H3,(H,27,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3.69E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93036
(CB2 Inhibitor, 12)Show SMILES CCCn1c(SCC(=O)NCC2COc3ccccc3O2)nc2sc3CCCc3c2c1=O Show InChI InChI=1S/C23H25N3O4S2/c1-2-10-26-22(28)20-15-6-5-9-18(15)32-21(20)25-23(26)31-13-19(27)24-11-14-12-29-16-7-3-4-8-17(16)30-14/h3-4,7-8,14H,2,5-6,9-13H2,1H3,(H,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM93037
(CB2 Inhibitor, 13)Show InChI InChI=1S/C22H30N2OS/c1-24(2)19(20-12-9-15-26-20)17-23-21(25)22(13-7-4-8-14-22)16-18-10-5-3-6-11-18/h3,5-6,9-12,15,19H,4,7-8,13-14,16-17H2,1-2H3,(H,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 7.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Laboratoire de Chimie Thérapeutique
| Assay Description
Competitive binding assay using cannabinoid receptors. |
Chem Biol Drug Des 81: 442-454 (2013)
Article DOI: 10.1111/cbdd.12095
BindingDB Entry DOI: 10.7270/Q20000PK |
More data for this
Ligand-Target Pair | |
Search and Browse
