Found 11 hits Enz. Inhib. hit(s) with all data for entry = 4901 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 |
|---|
Melatonin receptor type 1B
(Homo sapiens (Human)) | BDBM29611
(2-Iodomelatonin | CHEMBL289233 | Melatonin,2-Iodo)Show InChI InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17) | PDB
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| Article
PubMed
| 0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM29611
(2-Iodomelatonin | CHEMBL289233 | Melatonin,2-Iodo)Show InChI InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17) | KEGG
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| Article
PubMed
| 0.0300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1B
(Homo sapiens (Human)) | BDBM9019
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16) | PDB
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| DrugBank
Article
PubMed
| 0.230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM9019
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16) | KEGG
UniProtKB/SwissProt
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| Article
PubMed
| 0.240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM50043289
(CHEMBL34730 | N-[2-(6-Chloro-5-methoxy-1H-indol-3-...)Show InChI InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17) | KEGG
UniProtKB/SwissProt
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PC sid
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| Article
PubMed
| 0.25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1B
(Homo sapiens (Human)) | BDBM50043289
(CHEMBL34730 | N-[2-(6-Chloro-5-methoxy-1H-indol-3-...)Show InChI InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17) | PDB
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| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1B
(Homo sapiens (Human)) | BDBM82509
(Melatonin,6-Hydroxy | melatonin, 6-Hydroxy)Show InChI InChI=1S/C13H16N2O3/c1-8(16)14-4-3-9-7-15-11-6-12(17)13(18-2)5-10(9)11/h5-7,15,17H,3-4H2,1-2H3,(H,14,16) | PDB
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PC sid
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| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM82509
(Melatonin,6-Hydroxy | melatonin, 6-Hydroxy)Show InChI InChI=1S/C13H16N2O3/c1-8(16)14-4-3-9-7-15-11-6-12(17)13(18-2)5-10(9)11/h5-7,15,17H,3-4H2,1-2H3,(H,14,16) | KEGG
UniProtKB/SwissProt
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PC cid
PC sid
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| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM82271
(CAS_260803 | NAS | NSC_260803)Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3 | KEGG
UniProtKB/SwissProt
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PC cid
PC sid
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| Article
PubMed
| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1B
(Homo sapiens (Human)) | BDBM82271
(CAS_260803 | NAS | NSC_260803)Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3 | PDB
Reactome pathway
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PC cid
PC sid
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| Article
PubMed
| 170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
Melatonin receptor type 1A
(Sheep) | BDBM10755
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2 | KEGG
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| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Massachusetts General Hospital
Curated by PDSP Ki Database
| |
Neuron 13: 1177-85 (1994)
Article DOI: 10.1016/0896-6273(94)90055-8
BindingDB Entry DOI: 10.7270/Q27P8WXK |
More data for this
Ligand-Target Pair | |
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