Found 6 hits for monomerid = 50494583 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Adenosine receptor
(Rattus norvegicus (rat)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 228 | 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 | |
Adenosine receptors; A2a & A2b
(Homo sapiens (Human)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| 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 A3
(Homo sapiens (Human)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| 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-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 A2a and A3
(Rattus norvegicus (rat)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 2.04E+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)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 9.65E+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]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 | |
Amine oxidase [flavin-containing] B
(Homo sapiens (Human)) | BDBM50494583
(CHEMBL3093332)Show SMILES COc1cc(OC)cc(c1)N1CCCn2c1nc1n(C)c(=O)n(CC#C)c(=O)c21 Show InChI InChI=1S/C20H21N5O4/c1-5-7-25-18(26)16-17(22(2)20(25)27)21-19-23(8-6-9-24(16)19)13-10-14(28-3)12-15(11-13)29-4/h1,10-12H,6-9H2,2-4H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| 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-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 | |