Found 600 hits with Last Name = 'costantino' and Initial = 'g' 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 |
Nischarin
(RAT) | BDBM50387827
(CHEMBL2058635)Show InChI InChI=1S/C11H12ClIN2/c1-7-2-5-11(14-7)15-10-4-3-8(13)6-9(10)12/h3-4,6-7H,2,5H2,1H3,(H,14,15) | PDB
UniProtKB/SwissProt
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| Article PubMed
| 0.178 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50021809
((2,6-Dichloro-4-iodo-phenyl)-(4,5-dihydro-1H-imida...)Show SMILES Clc1cc(I)cc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1 Show InChI InChI=1S/C9H8Cl2IN3/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2H2,(H2,13,14,15) | PDB
UniProtKB/SwissProt
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| 0.794 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50091345
(CHEMBL2092861)Show InChI InChI=1S/C12H16N2/c1-10(12-13-7-8-14-12)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,14)/t10-/m0/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM81807
(ATIPAMEZOLE | CAS_104054-27-5 | NSC_71310)Show InChI InChI=1S/C14H16N2/c1-2-14(13-9-15-10-16-13)7-11-5-3-4-6-12(11)8-14/h3-6,9-10H,2,7-8H2,1H3,(H,15,16) | PDB
UniProtKB/SwissProt
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| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50240366
(2-(naphthalen-2-yl)-4,5-dihydro-1H-imidazole | 2-N...)Show InChI InChI=1S/C13H12N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-6,9H,7-8H2,(H,14,15) | PDB
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| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601014
(CHEMBL5170947) | PDB
UniProtKB/SwissProt
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| PC cid PC sid UniChem
| Article PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50085683
((+)-4-((S)-alpha,2,3-trimethylbenzyl)imidazole | 4...)Show InChI InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)/t11-/m0/s1 | PDB
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| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50179393
(Efaroxan)Show InChI InChI=1S/C13H16N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-6H,2,7-9H2,1H3,(H,14,15) | PDB
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| 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50019646
(2-(alpha-(2,6-Dichlorophenoxy)ethyl)2-imidazoline ...)Show InChI InChI=1S/C11H12Cl2N2O/c1-7(11-14-5-6-15-11)16-10-8(12)3-2-4-9(10)13/h2-4,7H,5-6H2,1H3,(H,14,15) | PDB
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| 5.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50070328
(CHEBI:8862 | Rilmenidine)Show InChI InChI=1S/C10H16N2O/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12) | PDB
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| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50138500
(2-((E)-Styryl)-4,5-dihydro-1H-imidazole | 2-styryl...)Show InChI InChI=1S/C11H12N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-7H,8-9H2,(H,12,13)/b7-6+ | PDB
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601018
(CHEMBL5207596) | PDB
UniProtKB/SwissProt
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| PC cid PC sid UniChem
| Article PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50179397
(CHEMBL1162356)Show InChI InChI=1S/C11H13ClN4/c12-10-3-1-2-8-6-16(7-9(8)10)15-11-13-4-5-14-11/h1-3H,4-7H2,(H2,13,14,15) | PDB
UniProtKB/SwissProt
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| Article PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50016897
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)Show SMILES Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1 Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14) | PDB
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| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Mineralocorticoid receptor
(Homo sapiens (Human)) | BDBM21725
((1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethy...)Show SMILES [H][C@@]12CC(=O)C(=CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |w:6.6,t:20| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
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| 37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Mineralocorticoid receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Mineralocorticoid receptor
(Homo sapiens (Human)) | BDBM50226465
(CHEMBL402063 | E-guggulsterone | pregna-4,17(20)-c...)Show SMILES CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |w:1.0,t:10| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB MMDB
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| 39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Mineralocorticoid receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146549
(CHEMBL3764222)Show InChI InChI=1S/C8H11NO2.ClH/c1-10-8-4-2-3-7(5-8)6-11-9;/h2-5H,6,9H2,1H3;1H | PDB
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| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146407
(CHEMBL3763469)Show InChI InChI=1S/C7H8BrNO.ClH/c8-7-3-1-2-6(4-7)5-10-9;/h1-4H,5,9H2;1H | PDB
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| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146448
(CHEMBL3764351)Show InChI InChI=1S/C8H11NO2.ClH/c1-10-8-4-2-7(3-5-8)6-11-9;/h2-5H,6,9H2,1H3;1H | PDB
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| 80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 2
(Homo sapiens (Human)) | BDBM50107108
((1S,2S,3R)-2-(Amino-carboxy-methyl)-3-[2-(9H-xanth...)Show SMILES NC([C@H]1[C@@H](CCC2c3ccccc3Oc3ccccc23)[C@@H]1C(O)=O)C(O)=O Show InChI InChI=1S/C21H21NO5/c22-19(21(25)26)17-14(18(17)20(23)24)10-9-11-12-5-1-3-7-15(12)27-16-8-4-2-6-13(11)16/h1-8,11,14,17-19H,9-10,22H2,(H,23,24)(H,25,26)/t14-,17+,18+,19?/m1/s1 | PDB
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| 85 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Antagonistic activity against stimulation of GTP (gamma) 35 S binding by glutamate in membranes from CHO cells expressing human Metabotropic glutamat... |
Bioorg Med Chem Lett 11: 3179-82 (2001)
BindingDB Entry DOI: 10.7270/Q27M08H1 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146526
(CHEMBL3765396)Show InChI InChI=1S/C7H8FNO.ClH/c8-7-3-1-6(2-4-7)5-10-9;/h1-4H,5,9H2;1H | PDB
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| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601022
(CHEMBL5181500) | PDB
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| PC cid PC sid UniChem
| Article PubMed
| 110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50016897
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)Show SMILES Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1 Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14) | PDB
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| 126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane incubated for 30 mins by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50029050
((-)-(R)-epinephrine | (-)-3,4-dihydroxy-alpha-((me...)Show InChI InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1 | PDB
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| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 4
(Rattus norvegicus (Rat)) | BDBM50007548
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1 | PDB
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| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Displacement of [3H]L-AP4 from rat recombinant mGluR4 expressed in BHK cells by SPA assay |
Bioorg Med Chem 15: 3161-70 (2007)
Article DOI: 10.1016/j.bmc.2007.02.040 BindingDB Entry DOI: 10.7270/Q2CN74RR |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 4
(Rattus norvegicus (Rat)) | BDBM50007548
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1 | PDB
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| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Displacement of [3H]L-AP4 from rat mGluR4 expressed in BHK cells |
Bioorg Med Chem Lett 16: 196-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.09.014 BindingDB Entry DOI: 10.7270/Q2DZ0932 |
More data for this Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM50226465
(CHEMBL402063 | E-guggulsterone | pregna-4,17(20)-c...)Show SMILES CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |w:1.0,t:10| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB
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| 201 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Progesterone receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50226465
(CHEMBL402063 | E-guggulsterone | pregna-4,17(20)-c...)Show SMILES CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |w:1.0,t:10| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB
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| 224 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Glucorticoid receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM21725
((1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethy...)Show SMILES [H][C@@]12CC(=O)C(=CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |w:6.6,t:20| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB
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| 224 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Progesterone receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Androgen receptor
(Homo sapiens (Human)) | BDBM50226465
(CHEMBL402063 | E-guggulsterone | pregna-4,17(20)-c...)Show SMILES CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |w:1.0,t:10| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
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| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Androgen receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601016
(CHEMBL5204588) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM21725
((1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethy...)Show SMILES [H][C@@]12CC(=O)C(=CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |w:6.6,t:20| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB
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| 252 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Glucorticoid receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50070328
(CHEBI:8862 | Rilmenidine)Show InChI InChI=1S/C10H16N2O/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
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| Article PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50412260
(CHEMBL273485)Show InChI InChI=1S/C11H14N2O/c1-9(11-12-7-8-13-11)14-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13) | PDB
UniProtKB/SwissProt
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| Article PubMed
| 309 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Androgen receptor
(Homo sapiens (Human)) | BDBM21725
((1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethy...)Show SMILES [H][C@@]12CC(=O)C(=CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |w:6.6,t:20| Show InChI InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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| 315 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Inhibitory concentration against Androgen receptor |
J Med Chem 48: 6948-55 (2005)
Article DOI: 10.1021/jm0505056 BindingDB Entry DOI: 10.7270/Q20V8DKV |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50179398
(CHEMBL94022)Show SMILES [H][C@@]1(C[C@]1([H])c1ccccc1)C1=NCCN1 |t:13| Show InChI InChI=1S/C12H14N2/c1-2-4-9(5-3-1)10-8-11(10)12-13-6-7-14-12/h1-5,10-11H,6-8H2,(H,13,14)/t10-,11+/m1/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 347 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601013
(CHEMBL5179589) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50179396
(CHEMBL1907831)Show InChI InChI=1S/C12H16N2/c1-10(9-12-13-7-8-14-12)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,14)/t10-/m1/s1 | PDB
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 589 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146579
(Benzyl-O-Hydroxylamine | CHEMBL443652 | O-Benzylhy...)Show InChI InChI=1S/C7H9NO/c8-9-6-7-4-2-1-3-5-7/h1-5H,6,8H2 | PDB
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| 600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50179395
(CHEMBL14640)Show InChI InChI=1S/C10H12N2O/c1-2-4-9(5-3-1)13-8-10-11-6-7-12-10/h1-5H,6-8H2,(H,11,12) | PDB
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| 708 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601019
(CHEMBL5199538) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 720 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50179391
(CHEMBL3593723)Show InChI InChI=1S/C20H24N2/c1-21-14-7-6-8-16(21)13-15-22-19-11-4-2-9-17(19)18-10-3-5-12-20(18)22/h2-5,9-12,16H,6-8,13-15H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [3H]RS-79948-197 from recombinant human alpha2A adrenoreceptor expressed in CHOK1 cell membrane by scintillation counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50019848
(2-(2,3-dihydro-1,4-benzodioxin-2-yl)-4,5-dihydro-1...)Show InChI InChI=1S/C11H12N2O2/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10H,5-7H2,(H,12,13) | PDB
UniProtKB/SwissProt
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| Article PubMed
| 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Belgrade
Curated by ChEMBL
| Assay Description Displacement of [125I]PIC from Imidazoline-1 receptor in rat PC12 cell membrane by gamma counting method |
Bioorg Med Chem 24: 3174-83 (2016)
Article DOI: 10.1016/j.bmc.2016.05.043 BindingDB Entry DOI: 10.7270/Q2NZ89J3 |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Rattus norvegicus (Rat)) | BDBM50007548
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1 | PDB
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| 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Displacement of [3H]LY341495 from rat recombinant mGluR8 expressed in BHK cells by SPA assay |
Bioorg Med Chem 15: 3161-70 (2007)
Article DOI: 10.1016/j.bmc.2007.02.040 BindingDB Entry DOI: 10.7270/Q2CN74RR |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Metabotropic glutamate receptor 8
(Rattus norvegicus (Rat)) | BDBM50007548
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1 | PDB
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| 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Displacement of [3H]LY341495 from rat mGluR8 expressed in BHK cells |
Bioorg Med Chem Lett 16: 196-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.09.014 BindingDB Entry DOI: 10.7270/Q2DZ0932 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50601021
(CHEMBL5207995) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146551
(CHEMBL3763498)Show InChI InChI=1S/C13H13NO.ClH/c14-15-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;/h1-9H,10,14H2;1H | PDB
UniProtKB/SwissProt
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| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 2
(Homo sapiens (Human)) | BDBM50107109
((1S,2S,3R)-2-(Amino-carboxy-methyl)-3-(9H-xanthen-...)Show SMILES NC([C@H]1[C@@H](CC2c3ccccc3Oc3ccccc23)[C@@H]1C(O)=O)C(O)=O Show InChI InChI=1S/C20H19NO5/c21-18(20(24)25)16-13(17(16)19(22)23)9-12-10-5-1-3-7-14(10)26-15-8-4-2-6-11(12)15/h1-8,12-13,16-18H,9,21H2,(H,22,23)(H,24,25)/t13-,16+,17+,18?/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Antagonistic activity against stimulation of GTP (gamma) 35 S binding by glutamate in membranes from CHO cells expressing human Metabotropic glutamat... |
Bioorg Med Chem Lett 11: 3179-82 (2001)
BindingDB Entry DOI: 10.7270/Q27M08H1 |
More data for this Ligand-Target Pair | |
Metabotropic glutamate receptor 8
(Rattus norvegicus (Rat)) | BDBM17657
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1 | PDB
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Perugia
Curated by ChEMBL
| Assay Description Displacement of [3H]LY341495 from rat mGluR8 expressed in BHK cells |
Bioorg Med Chem Lett 16: 196-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.09.014 BindingDB Entry DOI: 10.7270/Q2DZ0932 |
More data for this Ligand-Target Pair | |
Alanine--glyoxylate aminotransferase
(Homo sapiens) | BDBM50146408
(CHEMBL3764504)Show InChI InChI=1S/C7H8FNO.ClH/c8-7-3-1-2-6(4-7)5-10-9;/h1-4H,5,9H2;1H | PDB
UniProtKB/SwissProt
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| 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00142 BindingDB Entry DOI: 10.7270/Q25T3QJF |
More data for this Ligand-Target Pair | |