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Compile Data Set for Download or QSAR

Found 48 hits Enz. Inhib. hit(s) with Target = 'HTR5A' AND taxid = 10116   
Target
(Institution)
LigandTarget
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
pHTemp
°C
HTR5A


(RAT)
BDBM50371998
PNG
(CHEMBL404372)
Show SMILES C[C@@H]1NC(N)=Nc2cccc(Cl)c12
Show InChI InChI=1S/C9H10ClN3/c1-5-8-6(10)3-2-4-7(8)13-9(11)12-5/h2-5H,1H3,(H3,11,12,13)/t5-/m0/s1
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1.30n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Binding affinity to rat 5HT5A receptor


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50051944
PNG
(3-((1R,2S)-2-Dipropylamino-cyclopropyl)-phenol | C...)
Show SMILES CCCN(CCC)[C@H]1C[C@@H]1c1cccc(O)c1
Show InChI InChI=1S/C15H23NO/c1-3-8-16(9-4-2)15-11-14(15)12-6-5-7-13(17)10-12/h5-7,10,14-15,17H,3-4,8-9,11H2,1-2H3/t14-,15+/m1/s1
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2.60n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50371996
PNG
(CHEMBL541993)
Show SMILES C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c12
Show InChI InChI=1S/C11H12ClF2N3/c1-6-10-7(12)3-2-4-8(10)17-11(16-6)15-5-9(13)14/h2-4,6,9H,5H2,1H3,(H2,15,16,17)/t6-/m0/s1
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2.90n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Binding affinity to rat 5HT5A receptor


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50051956
PNG
(2-((1R,2S)-2-Dipropylamino-cyclopropyl)-phenol | C...)
Show SMILES CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1O
Show InChI InChI=1S/C15H23NO/c1-3-9-16(10-4-2)14-11-13(14)12-7-5-6-8-15(12)17/h5-8,13-14,17H,3-4,9-11H2,1-2H3/t13-,14+/m1/s1
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4.90n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50027065
PNG
((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
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
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PubMed
6.30n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM21392
PNG
(3-(2-aminoethyl)-1H-indole-5-carboxamide | 5-CT | ...)
Show SMILES NCCc1c[nH]c2ccc(cc12)C(N)=O
Show InChI InChI=1S/C11H13N3O/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10/h1-2,5-6,14H,3-4,12H2,(H2,13,15)
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12.6n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50027065
PNG
((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
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
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PubMed
15.7n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50051950
PNG
(CHEMBL34652 | [(1S,2R)-2-(2-Methoxy-phenyl)-cyclop...)
Show SMILES CCCN(CCC)[C@H]1C[C@@H]1c1ccccc1OC
Show InChI InChI=1S/C16H25NO/c1-4-10-17(11-5-2)15-12-14(15)13-8-6-7-9-16(13)18-3/h6-9,14-15H,4-5,10-12H2,1-3H3/t14-,15+/m1/s1
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17n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM78940
PNG
(METHIOTHEPIN | MLS000859918 | Methiothepin mesylat...)
Show SMILES CSc1ccc2Sc3ccccc3CC(N3CCN(C)CC3)c2c1
Show InChI InChI=1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20/h3-8,14,18H,9-13H2,1-2H3
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28.8n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288778
PNG
(3-((1S,2R)-2-Dipropylaminomethyl-cyclopropyl)-phen...)
Show SMILES CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(O)c1
Show InChI InChI=1S/C16H25NO/c1-3-8-17(9-4-2)12-14-11-16(14)13-6-5-7-15(18)10-13/h5-7,10,14,16,18H,3-4,8-9,11-12H2,1-2H3/t14-,16+/m0/s1
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58n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM78940
PNG
(METHIOTHEPIN | MLS000859918 | Methiothepin mesylat...)
Show SMILES CSc1ccc2Sc3ccccc3CC(N3CCN(C)CC3)c2c1
Show InChI InChI=1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20/h3-8,14,18H,9-13H2,1-2H3
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146n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288773
PNG
(3-((1S,2S)-2-Dipropylaminomethyl-cyclopropyl)-phen...)
Show SMILES CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(O)c1
Show InChI InChI=1S/C16H25NO/c1-3-8-17(9-4-2)12-14-11-16(14)13-6-5-7-15(18)10-13/h5-7,10,14,16,18H,3-4,8-9,11-12H2,1-2H3/t14-,16-/m1/s1
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186n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50031942
PNG
((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
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
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195n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288781
PNG
(CHEMBL134331 | [(1S,2S)-2-(2-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1OC
Show InChI InChI=1S/C17H27NO/c1-4-10-18(11-5-2)13-14-12-16(14)15-8-6-7-9-17(15)19-3/h6-9,14,16H,4-5,10-13H2,1-3H3/t14-,16+/m1/s1
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239n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
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
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240n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288780
PNG
(CHEMBL336124 | [(1S,2S)-2-(3-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)C[C@H]1C[C@@H]1c1cccc(OC)c1
Show InChI InChI=1S/C17H27NO/c1-4-9-18(10-5-2)13-15-12-17(15)14-7-6-8-16(11-14)19-3/h6-8,11,15,17H,4-5,9-10,12-13H2,1-3H3/t15-,17-/m1/s1
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310n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288782
PNG
(2-((1S,2R)-2-Dipropylaminomethyl-cyclopropyl)-phen...)
Show SMILES CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1O
Show InChI InChI=1S/C16H25NO/c1-3-9-17(10-4-2)12-13-11-15(13)14-7-5-6-8-16(14)18/h5-8,13,15,18H,3-4,9-12H2,1-2H3/t13-,15-/m0/s1
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379n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288775
PNG
(CHEMBL133935 | [(1R,2S)-2-(3-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)C[C@@H]1C[C@@H]1c1cccc(OC)c1
Show InChI InChI=1S/C17H27NO/c1-4-9-18(10-5-2)13-15-12-17(15)14-7-6-8-16(11-14)19-3/h6-8,11,15,17H,4-5,9-10,12-13H2,1-3H3/t15-,17+/m0/s1
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388n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288783
PNG
(CHEMBL423527 | Diethyl-[(1S,2S)-2-(2-methoxy-pheny...)
Show SMILES CCN(CC)C[C@H]1C[C@@H]1c1ccccc1OC
Show InChI InChI=1S/C15H23NO/c1-4-16(5-2)11-12-10-14(12)13-8-6-7-9-15(13)17-3/h6-9,12,14H,4-5,10-11H2,1-3H3/t12-,14+/m1/s1
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431n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288776
PNG
(2-((1S,2S)-2-Diethylaminomethyl-cyclopropyl)-pheno...)
Show SMILES CCN(CC)C[C@H]1C[C@@H]1c1ccccc1O
Show InChI InChI=1S/C14H21NO/c1-3-15(4-2)10-11-9-13(11)12-7-5-6-8-14(12)16/h5-8,11,13,16H,3-4,9-10H2,1-2H3/t11-,13+/m1/s1
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506n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288774
PNG
(CHEMBL334553 | [(1R,2R)-2-(3-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)[C@@H]1C[C@@H]1c1cccc(OC)c1
Show InChI InChI=1S/C16H25NO/c1-4-9-17(10-5-2)16-12-15(16)13-7-6-8-14(11-13)18-3/h6-8,11,15-16H,4-5,9-10,12H2,1-3H3/t15-,16-/m1/s1
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736n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288779
PNG
(2-((1S,2S)-2-Dipropylaminomethyl-cyclopropyl)-phen...)
Show SMILES CCCN(CCC)C[C@H]1C[C@@H]1c1ccccc1O
Show InChI InChI=1S/C16H25NO/c1-3-9-17(10-4-2)12-13-11-15(13)14-7-5-6-8-16(14)18/h5-8,13,15,18H,3-4,9-12H2,1-2H3/t13-,15+/m1/s1
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752n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288777
PNG
(CHEMBL135894 | [(1R,2S)-2-(2-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)C[C@@H]1C[C@@H]1c1ccccc1OC
Show InChI InChI=1S/C17H27NO/c1-4-10-18(11-5-2)13-14-12-16(14)15-8-6-7-9-17(15)19-3/h6-9,14,16H,4-5,10-13H2,1-3H3/t14-,16-/m0/s1
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998n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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PubMed
1.00E+3n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50031942
PNG
((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
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
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM35234
PNG
(DL-[7-3H]norepinephrine | NOREPINEPHRINE | Noradre...)
Show SMILES NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2
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PubMed
1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50010301
PNG
(8-Bromo-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-be...)
Show SMILES CN1CCc2cc(Br)c(O)cc2C(C1)c1ccccc1
Show InChI InChI=1S/C17H18BrNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50013515
PNG
((+)-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
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
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PubMed
1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50000492
PNG
((zacopride)4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl...)
Show SMILES COc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2
Show InChI InChI=1S/C15H20ClN3O2/c1-21-14-7-12(17)11(16)6-10(14)15(20)18-13-8-19-4-2-9(13)3-5-19/h6-7,9,13H,2-5,8,17H2,1H3,(H,18,20)
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM30704
PNG
((phenylmethyl) N-[[(6aR,9S,10aR)-4,7-dimethyl-6,6a...)
Show SMILES CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]2[C@H]1Cc1cn(C)c3cccc2c13
Show InChI InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/t18-,21+,23+/m0/s1
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PubMed
1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50024204
PNG
(1H-imidazo[4,5-c]pyridine derivative | 2N-[4,7-dim...)
Show SMILES CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1
Show InChI InChI=1S/C18H26N4O2S/c1-20(2)25(23,24)19-13-9-15-14-6-5-7-16-18(14)12(10-21(16)3)8-17(15)22(4)11-13/h5-7,10,13,15,17,19H,8-9,11H2,1-4H3/t13-,15+,17+/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM9019
PNG
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1
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)
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50013515
PNG
((+)-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
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
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1.00E+3n/an/an/an/an/an/an/an/a



University of Alberta

Curated by PDSP Ki Database




Neuropharmacology 33: 275-317

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM28582
PNG
(1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amine | CHE...)
Show SMILES COc1cc(CC(C)N)c(OC)cc1I
Show InChI InChI=1S/C11H16INO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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1.00E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106251
PNG
(2-(1-Benzenesulfonyl-1H-indol-4-yl)-ethylamine | C...)
Show SMILES NCCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H16N2O2S/c17-11-9-13-5-4-8-16-15(13)10-12-18(16)21(19,20)14-6-2-1-3-7-14/h1-8,10,12H,9,11,17H2
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1.20E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
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
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1.33E+3n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 90: 3452-6 (1993)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106246
PNG
(CHEMBL126340 | [1-Benzenesulfonyl-4-(2-dimethylami...)
Show SMILES CN(C)CCc1cccc2n(c(cc12)C(=O)c1ccccc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H24N2O3S/c1-26(2)17-16-19-12-9-15-23-22(19)18-24(25(28)20-10-5-3-6-11-20)27(23)31(29,30)21-13-7-4-8-14-21/h3-15,18H,16-17H2,1-2H3
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1.60E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106249
PNG
(CHEMBL92139 | [2-(1-Benzenesulfonyl-1H-indol-4-yl)...)
Show SMILES CN(C)CCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H20N2O2S/c1-19(2)13-11-15-7-6-10-18-17(15)12-14-20(18)23(21,22)16-8-4-3-5-9-16/h3-10,12,14H,11,13H2,1-2H3
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3.40E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106250
PNG
(CHEMBL93868 | N,N-dimethyl-2-(1-(phenylsulfonyl)-1...)
Show SMILES CN(C)CCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H20N2O2S/c1-19(2)13-12-15-14-20(18-11-7-6-10-17(15)18)23(21,22)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3
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4.00E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106252
PNG
(CHEMBL263700 | [3-(2-Dimethylamino-ethyl)-5-hydrox...)
Show SMILES CN(C)CCc1cn(C(=O)c2ccccc2)c2ccc(O)cc12
Show InChI InChI=1S/C19H20N2O2/c1-20(2)11-10-15-13-21(18-9-8-16(22)12-17(15)18)19(23)14-6-4-3-5-7-14/h3-9,12-13,22H,10-11H2,1-2H3
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4.50E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM34141
PNG
(CHEMBL76237 | MS-245)
Show SMILES COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C19H22N2O3S/c1-20(2)12-11-15-14-21(19-10-9-16(24-3)13-18(15)19)25(22,23)17-7-5-4-6-8-17/h4-10,13-14H,11-12H2,1-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50106248
PNG
((4S,5S)-4-Dimethylamino-1-(toluene-4-sulfonyl)-1,3...)
Show SMILES CN(C)[C@H]1Cc2cn(c3cccc([C@@H]1O)c23)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C20H22N2O3S/c1-13-7-9-15(10-8-13)26(24,25)22-12-14-11-18(21(2)3)20(23)16-5-4-6-17(22)19(14)16/h4-10,12,18,20,23H,11H2,1-3H3/t18-,20-/m0/s1
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>6.40E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 5A receptor in HEK 293 cells was determined using [3H]-LSD as radioligand


J Med Chem 44: 3881-95 (2001)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50094703
PNG
(5-(3-Bromo-phenyl)-7-(6-morpholin-4-yl-pyridin-3-y...)
Show SMILES Nc1ncnc2nc(cc(-c3cccc(Br)c3)c12)-c1ccc(nc1)N1CCOCC1
Show InChI InChI=1S/C22H19BrN6O/c23-16-3-1-2-14(10-16)17-11-18(28-22-20(17)21(24)26-13-27-22)15-4-5-19(25-12-15)29-6-8-30-9-7-29/h1-5,10-13H,6-9H2,(H2,24,26,27,28)
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>1.00E+4n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 295: 1156-64 (2000)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM35234
PNG
(DL-[7-3H]norepinephrine | NOREPINEPHRINE | Noradre...)
Show SMILES NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by PDSP Ki Database




NIDA Res Monogr 178: 440-66 (1998)

More data for this
Ligand-Target Pair
HTR5A


(RAT)
BDBM50288772
PNG
(CHEMBL132580 | [(1R,2R)-2-(2-Methoxy-phenyl)-cyclo...)
Show SMILES CCCN(CCC)[C@@H]1C[C@@H]1c1ccccc1OC
Show InChI InChI=1S/C16H25NO/c1-4-10-17(11-5-2)15-12-14(15)13-8-6-7-9-16(13)18-3/h6-9,14-15H,4-5,10-12H2,1-3H3/t14-,15-/m1/s1
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Article
>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of specific [3H]-OH-DPAT binding at 5-hydroxytryptamine 1A receptor in rat hippocampal membranes


Citation and Details
More data for this
Ligand-Target Pair