Found 6 hits Enz. Inhib. hit(s) with all data for entry = 5022 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 |
|---|
5-hydroxytryptamine receptor 5A
(MOUSE) | BDBM50027065
((5'alpha)-12'-hydroxy-2'-methyl-5'-(phenylmethyl)e...)Show SMILES CN1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N[C@]1(C)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O |r,c:4| Show InChI InChI=1S/C33H35N5O5/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32/h3-6,8-11,15,17,21,25-27,34,42H,7,12-14,16,18H2,1-2H3,(H,35,39)/t21-,25-,26+,27+,32-,33+/m1/s1 | PDB
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| Article
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| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(MOUSE) | BDBM50031942
((6aR,9R)-4,6a,7-Trimethyl-4,6,6a,7,8,9-hexahydro-i...)Show SMILES CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34 |r,c:24| Show InChI InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1 | PDB
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| 500 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(MOUSE) | 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 | PDB
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| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(MOUSE) | BDBM82080
(CAS_82-58-6 | LYSERGIC ACID | NSC_622688)Show SMILES CN1CC(C=C2C1Cc1c[nH]c3cccc2c13)C(O)=O |c:4| Show InChI InChI=1S/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,10,14,17H,6,8H2,1H3,(H,19,20) | PDB
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| 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(MOUSE) | BDBM50024206
(3-[2-(dimethylamino)ethyl]-1H-indol-5-ol | 3-[2-(d...)Show InChI InChI=1S/C12H16N2O/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12/h3-4,7-8,13,15H,5-6H2,1-2H3 | PDB
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| 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(MOUSE) | BDBM50013515
((+)-yohimbine | (16alpha,17alpha)-17-hydroxyyohimb...)Show SMILES COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r| Show InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1 | PDB
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| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institut
Curated by PDSP Ki Database
| |
FEBS Lett 377: 451-6 (1995)
Article DOI: 10.1016/0014-5793(95)01389-x
BindingDB Entry DOI: 10.7270/Q2M9076W |
More data for this
Ligand-Target Pair | |
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