Found 12 hits in this display 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 |
Adenosine receptor A2b
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Displacement of [3H]PSB-603 from human adenosine A2B receptor |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
Adenosine receptor A2a
(Rattus norvegicus (rat)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Jagiellonian University
Curated by ChEMBL
| Assay Description Displacement of [3H]MSX2 from adenosine A2A receptor in rat striatal membrane |
Bioorg Med Chem 15: 5003-17 (2007)
Article DOI: 10.1016/j.bmc.2007.04.018 BindingDB Entry DOI: 10.7270/Q2833RR7 |
More data for this Ligand-Target Pair | |
Adenosine receptor A2a
(Rattus norvegicus (rat)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Displacement of [3H]MSX-2 from adenosine A2A receptor in rat brain striatum |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
Adenosine receptor A1
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Displacement of [3H]CCPA from human adenosine A1 receptor expressed in CHO cells |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
Adenosine receptor A3
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Displacement of [3H]PSB-11 from human adenosine A3 receptor expressed in CHO cells |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
Adenosine receptor A1
(Rattus norvegicus (rat)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortex |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
Amine oxidase [flavin-containing] B
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 218 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human MAO-B |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
G-protein coupled receptor 55
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Antagonist activity at Prolink1-tagged human GPR55 receptor expressed in CHO cells assessed as inhibition of lysophosphatidylinositol-induced beta ar... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.0c00208 BindingDB Entry DOI: 10.7270/Q2PZ5DJH |
More data for this Ligand-Target Pair | |
N-arachidonyl glycine receptor
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Antagonist activity at Prolink1-tagged human GPR18 receptor expressed in CHO cells assessed as inhibition of THC-induced beta arrestin recruitment af... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.0c00208 BindingDB Entry DOI: 10.7270/Q2PZ5DJH |
More data for this Ligand-Target Pair | |
Amine oxidase [flavin-containing] A
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human MAO-A |
Bioorg Med Chem 21: 7435-52 (2013)
Article DOI: 10.1016/j.bmc.2013.09.044 BindingDB Entry DOI: 10.7270/Q2TT4TWF |
More data for this Ligand-Target Pair | |
G-protein coupled receptor 55
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
TBA
| Assay Description Agonist activity at Prolink1-tagged human GPR55 receptor expressed in CHO cells assessed as induction of beta-arrestin recruitment after 90 mins by b... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.0c00208 BindingDB Entry DOI: 10.7270/Q2PZ5DJH |
More data for this Ligand-Target Pair | |
N-arachidonyl glycine receptor
(Homo sapiens (Human)) | BDBM50212814
(9-(4-chlorobenzyl)-1,3-dimethyl-6,7,8,9-tetrahydro...)Show SMILES Cn1c2nc3N(Cc4ccc(Cl)cc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C17H18ClN5O2/c1-20-14-13(15(24)21(2)17(20)25)23-9-3-8-22(16(23)19-14)10-11-4-6-12(18)7-5-11/h4-7H,3,8-10H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
TBA
| Assay Description Agonist activity at Prolink1-tagged human GPR18 receptor expressed in CHO cells assessed as induction of beta-arrestin recruitment after 90 mins by b... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.0c00208 BindingDB Entry DOI: 10.7270/Q2PZ5DJH |
More data for this Ligand-Target Pair | |