Found 134 hits with Last Name = 'pucci' and Initial = 'l' 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 |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50049757
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
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CHEMBL PC cid PC sid PDB UniChem
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| Article PubMed
| 0.0350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]nicotine from alpha4beta2 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human)) | BDBM50110258
((6S)-2-(6-chloropyridin-3-yl)-9-azabicyclo[4.2.1]n...)Show SMILES Clc1ccc(cn1)C1=CCC[C@H]2CCC1N2 |t:8,THB:4:7:15:13.12| Show InChI InChI=1S/C13H15ClN2/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10/h3-4,7-8,10,12,16H,1-2,5-6H2/t10-,12?/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]epibatidine from nAChR alpha4beta2 receptor |
Bioorg Med Chem Lett 22: 829-32 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.052 BindingDB Entry DOI: 10.7270/Q2GM87SD |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human)) | BDBM50143320
((+)-epibatidine | (-)-1-epidatidine | (1S,2S,4R)-2...)Show SMILES Clc1ccc(cn1)[C@@H]1C[C@H]2CC[C@@H]1N2 |THB:4:7:13:11.10| Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8-,9+,10+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
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CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0450 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Sassari
Curated by ChEMBL
| Assay Description Binding affinity to alpha4beta2 nAChR (unknown origin) |
Eur J Med Chem 103: 429-37 (2015)
Article DOI: 10.1016/j.ejmech.2015.09.006 BindingDB Entry DOI: 10.7270/Q2HT2R5N |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human)) | BDBM50119791
(1-Decyl-3-((S)-1-methyl-pyrrolidin-2-yl)-pyridiniu...)Show InChI InChI=1S/C20H35N2/c1-3-4-5-6-7-8-9-10-16-22-17-11-13-19(18-22)20-14-12-15-21(20)2/h11,13,17-18,20H,3-10,12,14-16H2,1-2H3/q+1/t20-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Binding affinity to alpha4beta2 nAChR (unknown origin) |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human)) | BDBM50143302
((S)-1-dodecyl-3-(1-methylpyrrolidin-2-yl)pyridiniu...)Show InChI InChI=1S/C22H39N2/c1-3-4-5-6-7-8-9-10-11-12-18-24-19-13-15-21(20-24)22-16-14-17-23(22)2/h13,15,19-20,22H,3-12,14,16-18H2,1-2H3/q+1/t22-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Binding affinity to alpha4beta2 nAChR (unknown origin) |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50135594
((+/-)-2-(6-chloropyridin-3-yl)-9-aza-bicyclo[4.2.1...)Show SMILES Clc1ccc(cn1)C1=CCCC2CCC1N2 |t:8,THB:4:7:12.13:15| Show InChI InChI=1S/C13H15ClN2/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10/h3-4,7-8,10,12,16H,1-2,5-6H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]nicotine from alpha4beta2 nAChR in rat brain membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human)) | BDBM50110258
((6S)-2-(6-chloropyridin-3-yl)-9-azabicyclo[4.2.1]n...)Show SMILES Clc1ccc(cn1)C1=CCC[C@H]2CCC1N2 |t:8,THB:4:7:15:13.12| Show InChI InChI=1S/C13H15ClN2/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10/h3-4,7-8,10,12,16H,1-2,5-6H2/t10-,12?/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]nicotine from nAChR alpha4beta2 receptor |
Bioorg Med Chem Lett 22: 829-32 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.052 BindingDB Entry DOI: 10.7270/Q2GM87SD |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50261762
((+/-)-exo-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[...)Show SMILES Cc1cc(on1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8+,9-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50261762
((+/-)-exo-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[...)Show SMILES Cc1cc(on1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8+,9-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Binding affinity to alpha4beta2 nAChR (unknown origin) |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50261762
((+/-)-exo-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[...)Show SMILES Cc1cc(on1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8+,9-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]nicotine from alpha4beta2 nAChR in rat cerebral membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50261762
((+/-)-exo-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[...)Show SMILES Cc1cc(on1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8+,9-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]cystisine from alpha4beta2 nAChR (unknown origin) |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50005118
((S)-3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)...)Show InChI InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 2.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50116299
(CHEMBL3612360)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C30H45N3O2.BrH/c1-32-19-11-13-29(32)26-12-10-21-33(24-26)20-9-7-5-3-2-4-6-8-18-31-23-28-17-15-25-14-16-27(34)22-30(25)35-28;/h10,12,14,16,21-22,24,28-29,31H,2-9,11,13,15,17-20,23H2,1H3;1H/t28?,29-;/m0./s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 3.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D3 receptor (unknown origin) expressed in HEK293 cells after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50261762
((+/-)-exo-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[...)Show SMILES Cc1cc(on1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8+,9-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Homo sapiens (Human)) | BDBM50261766
((+/-)-exo-(1R,2R,4R)-2-(6-chloropyridin-3-yl)-7-az...)Show SMILES Clc1ccc(cn1)[C@H]1C[C@H]2CC[C@H]1N2 |r,THB:4:7:10.11:13| Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8-,9-,10-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Binding affinity to alpha4beta2 nAChR (unknown origin) |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50116300
(CHEMBL3612361)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C32H49N3O2.BrH/c1-34-21-13-15-31(34)28-14-12-23-35(26-28)22-11-9-7-5-3-2-4-6-8-10-20-33-25-30-19-17-27-16-18-29(36)24-32(27)37-30;/h12,14,16,18,23-24,26,30-31,33H,2-11,13,15,17,19-22,25H2,1H3;1H/t30?,31-;/m0./s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 9.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D3 receptor (unknown origin) expressed in HEK293 cells after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50049757
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
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CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| 10.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in rat cortical membrane |
Bioorg Med Chem 18: 4498-508 (2010)
Article DOI: 10.1016/j.bmc.2010.04.065 BindingDB Entry DOI: 10.7270/Q27M08XD |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Neuronal acetylcholine receptor subunit alpha-7
(Homo sapiens (Human)) | BDBM50135594
((+/-)-2-(6-chloropyridin-3-yl)-9-aza-bicyclo[4.2.1...)Show SMILES Clc1ccc(cn1)C1=CCCC2CCC1N2 |t:8,THB:4:7:12.13:15| Show InChI InChI=1S/C13H15ClN2/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10/h3-4,7-8,10,12,16H,1-2,5-6H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]methyllycaconitine from nAChR alpha7 receptor |
Bioorg Med Chem Lett 22: 829-32 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.052 BindingDB Entry DOI: 10.7270/Q2GM87SD |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358019
(CHEMBL1917546)Show SMILES BrC1=NOC2(C1)C[NH+]1CCC2CC1 |t:1,(-.22,2.73,;-1.69,2.25,;-2.93,3.16,;-4.18,2.25,;-3.7,.79,;-2.16,.79,;-3.7,-.75,;-5.03,-1.52,;-6.36,-.75,;-6.36,.79,;-5.03,1.56,;-5.82,.23,;-4.28,-.18,)| Show InChI InChI=1S/C9H13BrN2O/c10-8-5-9(13-11-8)6-12-3-1-7(9)2-4-12/h7H,1-6H2/p+1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 13.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50116299
(CHEMBL3612360)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C30H45N3O2.BrH/c1-32-19-11-13-29(32)26-12-10-21-33(24-26)20-9-7-5-3-2-4-6-8-18-31-23-28-17-15-25-14-16-27(34)22-30(25)35-28;/h10,12,14,16,21-22,24,28-29,31H,2-9,11,13,15,17-20,23H2,1H3;1H/t28?,29-;/m0./s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358020
(CHEMBL1917547)Show SMILES COC1=NOC2(C1)C[NH+]1CCC2CC1 |t:2,(16.18,3.94,;15.86,2.43,;14.39,1.96,;13.15,2.87,;11.9,1.96,;12.38,.5,;13.92,.5,;12.37,-1.04,;11.04,-1.8,;9.71,-1.04,;9.71,.5,;11.04,1.28,;10.26,-.05,;11.8,-.47,)| Show InChI InChI=1S/C10H16N2O2/c1-13-9-6-10(14-11-9)7-12-4-2-8(10)3-5-12/h8H,2-7H2,1H3/p+1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 14.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50116199
(CHEMBL3612359)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C26H37N3O2.BrH/c1-28-15-7-9-25(28)22-8-6-17-29(20-22)16-5-3-2-4-14-27-19-24-13-11-21-10-12-23(30)18-26(21)31-24;/h6,8,10,12,17-18,20,24-25,27H,2-5,7,9,11,13-16,19H2,1H3;1H/t24?,25-;/m0./s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D3 receptor (unknown origin) expressed in HEK293 cells after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50061679
(2-Hexylaminomethyl-chroman-7-ol; oxalic acid | CHE...)Show InChI InChI=1S/C16H25NO2/c1-2-3-4-5-10-17-12-15-9-7-13-6-8-14(18)11-16(13)19-15/h6,8,11,15,17-18H,2-5,7,9-10,12H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50035398
((S)-1-Methyl-2-(3-methyl-isoxazol-5-yl)-pyrrolidin...)Show InChI InChI=1S/C9H14N2O/c1-7-6-9(12-10-7)8-4-3-5-11(8)2/h6,8H,3-5H2,1-2H3/t8-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50116300
(CHEMBL3612361)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCCCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C32H49N3O2.BrH/c1-34-21-13-15-31(34)28-14-12-23-35(26-28)22-11-9-7-5-3-2-4-6-8-10-20-33-25-30-19-17-27-16-18-29(36)24-32(27)37-30;/h12,14,16,18,23-24,26,30-31,33H,2-11,13,15,17,19-22,25H2,1H3;1H/t30?,31-;/m0./s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Homo sapiens (Human)) | BDBM50035622
((5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,...)Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1 | Reactome pathway KEGG
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| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358021
(CHEMBL1917548)Show SMILES C1C(=NOC11C[NH+]2CCC1CC2)c1ccccc1 |c:1,(30.53,-.08,;31,1.39,;29.76,2.29,;28.51,1.39,;28.99,-.08,;28.99,-1.62,;27.66,-2.38,;26.33,-1.62,;26.33,-.08,;27.66,.7,;26.87,-.63,;28.41,-1.04,;32.34,2.15,;33.67,1.37,;35,2.13,;35.01,3.67,;33.67,4.45,;32.34,3.68,)| Show InChI InChI=1S/C15H18N2O/c1-2-4-12(5-3-1)14-10-15(18-16-14)11-17-8-6-13(15)7-9-17/h1-5,13H,6-11H2/p+1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Homo sapiens (Human)) | BDBM21544
((5Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(1E,3S)-3-hydroxyo...)Show SMILES CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O |r| Show InChI InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-/m0/s1 | Reactome pathway KEGG
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| Article PubMed
| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50116197
(CHEMBL3612358)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C25H35N3O2.BrH/c1-27-14-6-8-24(27)21-7-5-16-28(19-21)15-4-2-3-13-26-18-23-12-10-20-9-11-22(29)17-25(20)30-23;/h5,7,9,11,16-17,19,23-24,26H,2-4,6,8,10,12-15,18H2,1H3;1H/t23?,24-;/m0./s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D3 receptor (unknown origin) expressed in HEK293 cells after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Rattus norvegicus (Rat)) | BDBM21544
((5Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(1E,3S)-3-hydroxyo...)Show SMILES CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O |r| Show InChI InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-/m0/s1 | UniProtKB/SwissProt
GoogleScholar AffyNet
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Patents
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| Article PubMed
| 45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Rattus norvegicus (Rat)) | BDBM50035622
((5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,...)Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1 | UniProtKB/SwissProt
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CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
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| Article PubMed
| 45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50061652
(2-Propylaminomethyl-chroman-7-ol; oxalic acid | CH...)Show InChI InChI=1S/C13H19NO2/c1-2-7-14-9-12-6-4-10-3-5-11(15)8-13(10)16-12/h3,5,8,12,14-15H,2,4,6-7,9H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50261764
((+/-)-2-(3-methylisoxazol-5-yl)-7-aza-bicyclo[2.2....)Show SMILES Cc1cc(on1)C1=CC2CCC1N2 |t:7,THB:3:6:9.10:12| Show InChI InChI=1S/C10H12N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4-5,7,9,11H,2-3H2,1H3 | PDB
KEGG
UniProtKB/SwissProt
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| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50261763
((+/-)-endo-(1R,2R,4R)-2-(3-methylisoxazol-5-yl)-7-...)Show SMILES Cc1cc(on1)[C@@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8-,9-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
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| 70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]epibatidine from alpha4beta2 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50127648
(CHEMBL3628495)Show InChI InChI=1S/C10H12ClN3/c11-7-1-10(4-12-3-7)14-5-8-2-9(6-14)13-8/h1,3-4,8-9,13H,2,5-6H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 73 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Sassari
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight... |
Eur J Med Chem 103: 429-37 (2015)
Article DOI: 10.1016/j.ejmech.2015.09.006 BindingDB Entry DOI: 10.7270/Q2HT2R5N |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50036166
(3-(pyridin-3-yl)-1-azabicyclo[2.2.2]oct-2-ene | 3-...)Show SMILES C1CN2CCC1C(=C2)c1cccnc1 |c:7,THB:8:6:4.3:0.1,(-3.23,-2.16,;-4,-3.38,;-2.35,-2.5,;-2.35,-1.13,;-1.52,-.29,;-1.51,-1.39,;.03,-2.32,;-.76,-3.46,;1.54,-2,;2.57,-3.14,;4.08,-2.83,;4.56,-1.36,;3.52,-.21,;2.01,-.52,)| Show InChI InChI=1S/C12H14N2/c1-2-11(8-13-5-1)12-9-14-6-3-10(12)4-7-14/h1-2,5,8-10H,3-4,6-7H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 85 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]MLA from rat alpha7 nAChR |
Bioorg Med Chem Lett 19: 6353-7 (2009)
Article DOI: 10.1016/j.bmcl.2009.09.073 BindingDB Entry DOI: 10.7270/Q2T153QZ |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358023
(CHEMBL1917550)Show SMILES COC1=NOC2(C1)C[N+]1(C)CCC2CC1 |t:2,(12.27,-6.73,;11.95,-8.24,;10.49,-8.71,;9.24,-7.8,;7.99,-8.71,;8.47,-10.17,;10.01,-10.17,;8.47,-11.71,;7.14,-12.48,;7.12,-14.02,;5.81,-11.71,;5.81,-10.17,;7.14,-9.4,;6.35,-10.73,;7.89,-11.14,)| Show InChI InChI=1S/C11H19N2O2/c1-13-5-3-9(4-6-13)11(8-13)7-10(14-2)12-15-11/h9H,3-8H2,1-2H3/q+1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 91.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50116199
(CHEMBL3612359)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C26H37N3O2.BrH/c1-28-15-7-9-25(28)22-8-6-17-29(20-22)16-5-3-2-4-14-27-19-24-13-11-21-10-12-23(30)18-26(21)31-24;/h6,8,10,12,17-18,20,24-25,27H,2-5,7,9,11,13-16,19H2,1H3;1H/t24?,25-;/m0./s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 97 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Mus musculus) | BDBM21544
((5Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(1E,3S)-3-hydroxyo...)Show SMILES CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O |r| Show InChI InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-/m0/s1 | Reactome pathway KEGG
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| Article PubMed
| 98 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
Solute carrier organic anion transporter family member 2A1
(Mus musculus) | BDBM50035622
((5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,...)Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1 | Reactome pathway KEGG
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| 104 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Albert Einstein College of Medicine
Curated by ChEMBL
| Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells |
Am J Physiol 277: 734-41 (1999)
Article DOI: 10.1152/ajpregu.1999.277.3.R734 BindingDB Entry DOI: 10.7270/Q2902524 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358022
(CHEMBL1917549)Show SMILES C[N+]12CCC(CC1)C1(CC(Br)=NO1)C2 |c:11,(-5.4,-13.78,;-5.38,-12.24,;-6.71,-11.48,;-6.71,-9.94,;-5.38,-9.16,;-6.17,-10.49,;-4.63,-10.9,;-4.05,-9.94,;-2.51,-9.94,;-2.04,-8.48,;-.57,-8,;-3.28,-7.57,;-4.53,-8.48,;-4.05,-11.48,)| Show InChI InChI=1S/C10H16BrN2O/c1-13-4-2-8(3-5-13)10(7-13)6-9(11)12-14-10/h8H,2-7H2,1H3/q+1 | PDB
Reactome pathway KEGG
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| 109 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50116197
(CHEMBL3612358)Show SMILES [Br-].CN1CCC[C@H]1c1ccc[n+](CCCCCNCC2CCc3ccc(O)cc3O2)c1 |r| Show InChI InChI=1S/C25H35N3O2.BrH/c1-27-14-6-8-24(27)21-7-5-16-28(19-21)15-4-2-3-13-26-18-23-12-10-20-9-11-22(29)17-25(20)30-23;/h5,7,9,11,16-17,19,23-24,26H,2-4,6,8,10,12-15,18H2,1H3;1H/t23?,24-;/m0./s1 | PDB
Reactome pathway KEGG
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| 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [3H]raclopride from dopamine D2 receptor in Sprague-Dawley rat striatal membranes after 30 mins |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50036166
(3-(pyridin-3-yl)-1-azabicyclo[2.2.2]oct-2-ene | 3-...)Show SMILES C1CN2CCC1C(=C2)c1cccnc1 |c:7,THB:8:6:4.3:0.1,(-3.23,-2.16,;-4,-3.38,;-2.35,-2.5,;-2.35,-1.13,;-1.52,-.29,;-1.51,-1.39,;.03,-2.32,;-.76,-3.46,;1.54,-2,;2.57,-3.14,;4.08,-2.83,;4.56,-1.36,;3.52,-.21,;2.01,-.52,)| Show InChI InChI=1S/C12H14N2/c1-2-11(8-13-5-1)12-9-14-6-3-10(12)4-7-14/h1-2,5,8-10H,3-4,6-7H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from rat alpha7 nAChR |
Bioorg Med Chem Lett 19: 6353-7 (2009)
Article DOI: 10.1016/j.bmcl.2009.09.073 BindingDB Entry DOI: 10.7270/Q2T153QZ |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50127655
(CHEMBL3628496)Show InChI InChI=1S/C10H12BrN3/c11-7-1-10(4-12-3-7)14-5-8-2-9(6-14)13-8/h1,3-4,8-9,13H,2,5-6H2 | PDB
Reactome pathway KEGG
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| 176 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Sassari
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight... |
Eur J Med Chem 103: 429-37 (2015)
Article DOI: 10.1016/j.ejmech.2015.09.006 BindingDB Entry DOI: 10.7270/Q2HT2R5N |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50358024
(CHEMBL1917551)Show InChI InChI=1S/C8H11BrN2O/c9-7-3-8(12-10-7)5-11-2-1-6(8)4-11/h6H,1-5H2/p+1 | PDB
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| 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat cortical membranes by gamma counting |
Eur J Med Chem 46: 5790-9 (2011)
Article DOI: 10.1016/j.ejmech.2011.09.028 BindingDB Entry DOI: 10.7270/Q2QN676J |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50261763
((+/-)-endo-(1R,2R,4R)-2-(3-methylisoxazol-5-yl)-7-...)Show SMILES Cc1cc(on1)[C@@H]1C[C@H]2CC[C@H]1N2 |r,THB:3:6:9.10:12| Show InChI InChI=1S/C10H14N2O/c1-6-4-10(13-12-6)8-5-7-2-3-9(8)11-7/h4,7-9,11H,2-3,5H2,1H3/t7-,8-,9-/m1/s1 | PDB
Reactome pathway KEGG
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| 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM82070
(CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...)Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1 | PDB
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| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampus membrane homogenates by gamma counting |
Eur J Med Chem 101: 367-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.06.039 BindingDB Entry DOI: 10.7270/Q25M67H8 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50143282
((-)-cytisine | (1R,5S)-1,2,3,4,5,6-Hexahydro-1,5-m...)Show InChI InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8?,9-/m1/s1 | PDB
Reactome pathway KEGG
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| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in rat cortical membrane |
Bioorg Med Chem 18: 4498-508 (2010)
Article DOI: 10.1016/j.bmc.2010.04.065 BindingDB Entry DOI: 10.7270/Q27M08XD |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50302794
(4-(5-(quinuclidin-3-yl)pyridin-2-yl)morpholine | C...)Show SMILES C1CN(CCO1)c1ccc(cn1)C1CN2CCC1CC2 |THB:9:12:15.16:19.18,(3.32,-11.34,;2.01,-12.14,;.67,-11.41,;.61,-9.88,;1.93,-9.07,;3.28,-9.81,;-.64,-12.22,;-2,-11.49,;-3.3,-12.3,;-3.25,-13.82,;-1.91,-14.56,;-.6,-13.76,;-4.46,-14.78,;-4.16,-16.29,;-5.64,-15.6,;-7.29,-16.32,;-7.5,-14.82,;-5.92,-14.12,;-5.84,-12.35,;-5.36,-13.55,)| Show InChI InChI=1S/C16H23N3O/c1-2-16(19-7-9-20-10-8-19)17-11-14(1)15-12-18-5-3-13(15)4-6-18/h1-2,11,13,15H,3-10,12H2 | PDB
Reactome pathway KEGG
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| 350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from rat alpha7 nAChR |
Bioorg Med Chem Lett 19: 6353-7 (2009)
Article DOI: 10.1016/j.bmcl.2009.09.073 BindingDB Entry DOI: 10.7270/Q2T153QZ |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-7
(Rattus norvegicus (Rat)) | BDBM50261765
((-/+)-7-methyl-2-(3-methylisoxazol-5-yl)-7-aza-bic...)Show SMILES CN1C2CCC1C(=C2)c1cc(C)no1 |c:7,TLB:8:6:3.4:1| Show InChI InChI=1S/C11H14N2O/c1-7-5-11(14-12-7)9-6-8-3-4-10(9)13(8)2/h5-6,8,10H,3-4H2,1-2H3 | PDB
Reactome pathway KEGG
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| 394 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università degli Studi di Milano
Curated by ChEMBL
| Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in rat cortical membrane |
Bioorg Med Chem Lett 18: 4651-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.07.016 BindingDB Entry DOI: 10.7270/Q20C4VKW |
More data for this Ligand-Target Pair | |