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PubChem AID 613

Compile Data Set for Download or QSAR

Found 346 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30658
PNG
((7-Diethylamino-4-methyl-2-oxo-2H-chromen-3-yl)-ac...)
Show SMILES CCOC(=O)Cc1c(C)c2ccc(cc2oc1=O)N(CC)CC
Show InChI InChI=1S/C18H23NO4/c1-5-19(6-2)13-8-9-14-12(4)15(11-17(20)22-7-3)18(21)23-16(14)10-13/h8-10H,5-7,11H2,1-4H3
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n/an/an/an/a 4.44E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30696
PNG
(2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-y...)
Show SMILES C(c1ccccc1)n1nnc2c(ncnc12)N1CCc2ccccc2C1
Show InChI InChI=1S/C20H18N6/c1-2-6-15(7-3-1)12-26-20-18(23-24-26)19(21-14-22-20)25-11-10-16-8-4-5-9-17(16)13-25/h1-9,14H,10-13H2
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30714
PNG
(6-amino-2-isopropyl-8-phenyl-1,3,8,8a-tetrahydrois...)
Show SMILES CC(C)N1CCC2=C(C#N)C(=N)C(C#N)(C#N)C(C2C1)c1ccccc1
Show InChI InChI=1S/C21H21N5/c1-14(2)26-9-8-16-17(10-22)20(25)21(12-23,13-24)19(18(16)11-26)15-6-4-3-5-7-15/h3-7,14,18-19,25H,8-9,11H2,1-2H3
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n/an/an/an/a 6.96E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30717
PNG
(1-(3-benzyl-2-imino-benzimidazol-1-yl)-3-phenoxy-p...)
Show SMILES OC(COc1ccccc1)Cn1c2ccccc2n(Cc2ccccc2)c1=N
Show InChI InChI=1S/C23H23N3O2/c24-23-25(15-18-9-3-1-4-10-18)21-13-7-8-14-22(21)26(23)16-19(27)17-28-20-11-5-2-6-12-20/h1-14,19,24,27H,15-17H2
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30719
PNG
((3E)-6-hexyl-3-[(5E)-5-(6-ketocyclohexa-2,4-dien-1...)
Show SMILES CCCCCCC1=Cc2c\c(=C3\NN\C(O3)=C3\C=CC=CC3=O)c(=O)oc2=CC1=O
Show InChI InChI=1S/C23H22N2O5/c1-2-3-4-5-8-14-11-15-12-17(23(28)29-20(15)13-19(14)27)22-25-24-21(30-22)16-9-6-7-10-18(16)26/h6-7,9-13,24-25H,2-5,8H2,1H3/b21-16+,22-17+
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30724
PNG
(2-amino-6-hexyl-7-keto-N-methyl-chromene-3-carboxa...)
Show SMILES CCCCCCc1cc2cc(C(=O)NC)c(N)oc2cc1=O
Show InChI InChI=1S/C17H22N2O3/c1-3-4-5-6-7-11-8-12-9-13(17(21)19-2)16(18)22-15(12)10-14(11)20/h8-10H,3-7,18H2,1-2H3,(H,19,21)
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n/an/an/an/a 1.92E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30741
PNG
(2-amino-6-(4-chlorophenyl)-4-(5-methyl-3-furanyl)-...)
Show SMILES Cc1cc(co1)-c1cc(nc(N)c1C#N)-c1ccc(Cl)cc1
Show InChI InChI=1S/C17H12ClN3O/c1-10-6-12(9-22-10)14-7-16(21-17(20)15(14)8-19)11-2-4-13(18)5-3-11/h2-7,9H,1H3,(H2,20,21)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30748
PNG
(4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)...)
Show SMILES CCCOC(=O)c1ccc(Nc2cc(C)nc3ncnn23)cc1
Show InChI InChI=1S/C16H17N5O2/c1-3-8-23-15(22)12-4-6-13(7-5-12)20-14-9-11(2)19-16-17-10-18-21(14)16/h4-7,9-10,20H,3,8H2,1-2H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30750
PNG
(2-amino-1-[2-(1-cyclohexenyl)ethyl]-N-(2-methoxyet...)
Show SMILES COCCNC(=O)c1c(N)n(CCC2=CCCCC2)c2nc3ccccc3nc12
Show InChI InChI=1S/C22H27N5O2/c1-29-14-12-24-22(28)18-19-21(26-17-10-6-5-9-16(17)25-19)27(20(18)23)13-11-15-7-3-2-4-8-15/h5-7,9-10H,2-4,8,11-14,23H2,1H3,(H,24,28)
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n/an/an/an/a 1.31E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30756
PNG
((4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)m...)
Show SMILES CN(C)CCCN1C(C(C(=O)c2ccc3OCCOc3c2)C(=O)C1=O)c1ccccn1
Show InChI InChI=1S/C23H25N3O5/c1-25(2)10-5-11-26-20(16-6-3-4-9-24-16)19(22(28)23(26)29)21(27)15-7-8-17-18(14-15)31-13-12-30-17/h3-4,6-9,14,19-20H,5,10-13H2,1-2H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30771
PNG
(2-amino-1-(3-morpholinopropyl)-N-piperonyl-pyrrolo...)
Show SMILES Nc1c(C(=O)NCc2ccc3OCOc3c2)c2nc3ccccc3nc2n1CCCN1CCOCC1
Show InChI InChI=1S/C26H28N6O4/c27-24-22(26(33)28-15-17-6-7-20-21(14-17)36-16-35-20)23-25(30-19-5-2-1-4-18(19)29-23)32(24)9-3-8-31-10-12-34-13-11-31/h1-2,4-7,14H,3,8-13,15-16,27H2,(H,28,33)
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n/an/an/an/a 1.10E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30779
PNG
(1-(4-bromophenyl)-2-[4-(phenylmethyl)-1-piperaziny...)
Show SMILES Brc1ccc(cc1)C(=O)CN1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C19H21BrN2O/c20-18-8-6-17(7-9-18)19(23)15-22-12-10-21(11-13-22)14-16-4-2-1-3-5-16/h1-9H,10-15H2
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30780
PNG
((2S)-2-[(2,4-dimethylphenyl)carbamoylamino]-4-(met...)
Show SMILES CSCC[C@H](NC(=O)Nc1ccc(C)cc1C)C(O)=O
Show InChI InChI=1S/C14H20N2O3S/c1-9-4-5-11(10(2)8-9)15-14(19)16-12(13(17)18)6-7-20-3/h4-5,8,12H,6-7H2,1-3H3,(H,17,18)(H2,15,16,19)/t12-/m0/s1
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30781
PNG
(2-[[2-(3,5-dimethyl-1-pyrazolyl)-5,6,7,8-tetrahydr...)
Show SMILES Cc1cc(C)n(n1)-c1nc(NCCO)c2c3CCCCc3sc2n1
Show InChI InChI=1S/C17H21N5OS/c1-10-9-11(2)22(21-10)17-19-15(18-7-8-23)14-12-5-3-4-6-13(12)24-16(14)20-17/h9,23H,3-8H2,1-2H3,(H,18,19,20)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30784
PNG
(1-(5-methyl-1,2-oxazol-3-yl)-2,5-bis(oxidanylidene...)
Show SMILES Cc1cc(no1)-n1c2nc3ccccn3c(=O)c2cc(C#N)c1=O
Show InChI InChI=1S/C16H9N5O3/c1-9-6-13(19-24-9)21-14-11(7-10(8-17)15(21)22)16(23)20-5-3-2-4-12(20)18-14/h2-7H,1H3
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n/an/an/an/a 7.50E+3n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30787
PNG
(MLS000083871 | N-(2-furanylmethyl)-N-[(2-oxo-1H-qu...)
Show SMILES O=C(N(Cc1ccco1)Cc1cc2ccccc2[nH]c1=O)c1cccs1
Show InChI InChI=1S/C20H16N2O3S/c23-19-15(11-14-5-1-2-7-17(14)21-19)12-22(13-16-6-3-9-25-16)20(24)18-8-4-10-26-18/h1-11H,12-13H2,(H,21,23)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30798
PNG
(MLS000048481 | N-(4-acetylphenyl)-2-[3-(2-methoxye...)
Show SMILES COCCN1C(=O)C(CC(=O)Nc2ccc(cc2)C(C)=O)SC1=Nc1ccccc1
Show InChI InChI=1S/C22H23N3O4S/c1-15(26)16-8-10-18(11-9-16)23-20(27)14-19-21(28)25(12-13-29-2)22(30-19)24-17-6-4-3-5-7-17/h3-11,19H,12-14H2,1-2H3,(H,23,27)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30841
PNG
(2-[[2-[4-keto-6-methyl-5-(4-methylpiperidino)sulfo...)
Show SMILES CCOC(=O)CNC(=O)Cn1cnc2sc(C)c(c2c1=O)S(=O)(=O)N1CCC(C)CC1
Show InChI InChI=1S/C19H26N4O6S2/c1-4-29-15(25)9-20-14(24)10-22-11-21-18-16(19(22)26)17(13(3)30-18)31(27,28)23-7-5-12(2)6-8-23/h11-12H,4-10H2,1-3H3,(H,20,24)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30848
PNG
(4-methyl-N-(2-pyridinylmethyl)-2-furo[3,2-c]quinol...)
Show SMILES Cc1nc2ccccc2c2oc(cc12)C(=O)NCc1ccccn1
Show InChI InChI=1S/C19H15N3O2/c1-12-15-10-17(19(23)21-11-13-6-4-5-9-20-13)24-18(15)14-7-2-3-8-16(14)22-12/h2-10H,11H2,1H3,(H,21,23)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30860
PNG
(5-bromanyl-N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-...)
Show SMILES Clc1ccccc1-c1nc2cc(NC(=O)c3cncc(Br)c3)ccc2o1
Show InChI InChI=1S/C19H11BrClN3O2/c20-12-7-11(9-22-10-12)18(25)23-13-5-6-17-16(8-13)24-19(26-17)14-3-1-2-4-15(14)21/h1-10H,(H,23,25)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30862
PNG
(1-allyl-2,5-diketo-dipyrido[1,2-d:3',4'-f]pyrimidi...)
Show SMILES C=CCn1c2nc3ccccn3c(=O)c2cc(C#N)c1=O
Show InChI InChI=1S/C15H10N4O2/c1-2-6-19-13-11(8-10(9-16)14(19)20)15(21)18-7-4-3-5-12(18)17-13/h2-5,7-8H,1,6H2
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n/an/an/an/a 2.40E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30873
PNG
(2-(4-pyridyl)-5-[[2-(4-pyridyl)-1,3-benzoxazol-5-y...)
Show SMILES O=S(=O)(c1ccc2oc(nc2c1)-c1ccncc1)c1ccc2oc(nc2c1)-c1ccncc1
Show InChI InChI=1S/C24H14N4O4S/c29-33(30,17-1-3-21-19(13-17)27-23(31-21)15-5-9-25-10-6-15)18-2-4-22-20(14-18)28-24(32-22)16-7-11-26-12-8-16/h1-14H
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30895
PNG
(2-(2-cyanoethylsulfanyl)-6-(5-methylfuran-2-yl)-4-...)
Show SMILES Cc1ccc(o1)-c1cc(c(C#N)c(SCCC#N)n1)C(F)(F)F
Show InChI InChI=1S/C15H10F3N3OS/c1-9-3-4-13(22-9)12-7-11(15(16,17)18)10(8-20)14(21-12)23-6-2-5-19/h3-4,7H,2,6H2,1H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30901
PNG
(10-methyl-15-oxo-6,21-dioxa-14-azahexacyclo[16.2.1...)
Show SMILES Cc1ccc2N3C(C4CCOC4c2c1)C12OC(C=C1)C(C2C3=O)C(O)=O
Show InChI InChI=1S/C20H19NO5/c1-9-2-3-12-11(8-9)16-10(5-7-25-16)17-20-6-4-13(26-20)14(19(23)24)15(20)18(22)21(12)17/h2-4,6,8,10,13-17H,5,7H2,1H3,(H,23,24)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30903
PNG
(7-ethyl-1-(2-keto-2-morpholino-ethyl)indole-3-carb...)
Show SMILES CCc1cccc2c(cn(CC(=O)N3CCOCC3)c12)C#N
Show InChI InChI=1S/C17H19N3O2/c1-2-13-4-3-5-15-14(10-18)11-20(17(13)15)12-16(21)19-6-8-22-9-7-19/h3-5,11H,2,6-9,12H2,1H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30904
PNG
(5-methyl-N-(3-pyridinylmethyl)-3-thiophenecarboxam...)
Show SMILES Cc1cc(cs1)C(=O)NCc1cccnc1
Show InChI InChI=1S/C12H12N2OS/c1-9-5-11(8-16-9)12(15)14-7-10-3-2-4-13-6-10/h2-6,8H,7H2,1H3,(H,14,15)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30912
PNG
(2-{[(3,5-dimethyl-4-isoxazolyl)methyl]thio}-1H-ben...)
Show SMILES Cc1noc(C)c1CSc1nc2ccccc2[nH]1
Show InChI InChI=1S/C13H13N3OS/c1-8-10(9(2)17-16-8)7-18-13-14-11-5-3-4-6-12(11)15-13/h3-6H,7H2,1-2H3,(H,14,15)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30917
PNG
(MLS000100253 | N-(5-chloranylpyridin-2-yl)pyrazolo...)
Show SMILES Clc1ccc(NC(=O)c2cnn3cccnc23)nc1
Show InChI InChI=1S/C12H8ClN5O/c13-8-2-3-10(15-6-8)17-12(19)9-7-16-18-5-1-4-14-11(9)18/h1-7H,(H,15,17,19)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30922
PNG
(2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydroind...)
Show SMILES CC1Cc2cc(ccc2N1S(=O)(=O)c1ccc(C)cc1)S(N)(=O)=O
Show InChI InChI=1S/C16H18N2O4S2/c1-11-3-5-14(6-4-11)24(21,22)18-12(2)9-13-10-15(23(17,19)20)7-8-16(13)18/h3-8,10,12H,9H2,1-2H3,(H2,17,19,20)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30927
PNG
(MLS000061186 | N-(8-quinolinyl)-3-pyridinecarboxam...)
Show SMILES O=C(Nc1cccc2cccnc12)c1cccnc1
Show InChI InChI=1S/C15H11N3O/c19-15(12-6-2-8-16-10-12)18-13-7-1-4-11-5-3-9-17-14(11)13/h1-10H,(H,18,19)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30941
PNG
(3-[2-hydroxy-3-(4-propanoylphenoxy)propyl]-5,5-dim...)
Show SMILES CCC(=O)c1ccc(OCC(O)CN2C(=O)NC(C)(C)C2=O)cc1
Show InChI InChI=1S/C17H22N2O5/c1-4-14(21)11-5-7-13(8-6-11)24-10-12(20)9-19-15(22)17(2,3)18-16(19)23/h5-8,12,20H,4,9-10H2,1-3H3,(H,18,23)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30944
PNG
(MLS000117778 | N-(2,5-dimethylphenyl)-4-(4-fluorob...)
Show SMILES Cc1ccc(C)c(NC(=O)c2ccc3c(c2)N(Cc2ccc(F)cc2)C(=O)CS3=O)c1
Show InChI InChI=1S/C24H21FN2O3S/c1-15-3-4-16(2)20(11-15)26-24(29)18-7-10-22-21(12-18)27(23(28)14-31(22)30)13-17-5-8-19(25)9-6-17/h3-12H,13-14H2,1-2H3,(H,26,29)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30952
PNG
(1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)-N-piper...)
Show SMILES CCn1c(cc2sccc12)C(=O)N1CCC(CC1)C(=O)NCc1ccc2OCOc2c1
Show InChI InChI=1S/C23H25N3O4S/c1-2-26-17-7-10-31-21(17)12-18(26)23(28)25-8-5-16(6-9-25)22(27)24-13-15-3-4-19-20(11-15)30-14-29-19/h3-4,7,10-12,16H,2,5-6,8-9,13-14H2,1H3,(H,24,27)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30961
PNG
(3-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-...)
Show SMILES Cn1c2ccc(cc2oc1=O)S(=O)(=O)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C17H18N4O4S/c1-19-14-6-5-13(12-15(14)25-17(19)22)26(23,24)21-10-8-20(9-11-21)16-4-2-3-7-18-16/h2-7,12H,8-11H2,1H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30965
PNG
(6-[4-(2-chlorophenyl)-1-piperazinyl]-7H-purine | 6...)
Show SMILES Clc1ccccc1N1CCN(CC1)c1ncnc2nc[nH]c12
Show InChI InChI=1S/C15H15ClN6/c16-11-3-1-2-4-12(11)21-5-7-22(8-6-21)15-13-14(18-9-17-13)19-10-20-15/h1-4,9-10H,5-8H2,(H,17,18,19,20)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30966
PNG
(2-acetamido-N-(2,5-dichlorophenyl)-4-mesyl-butyram...)
Show SMILES CC(=O)NC(CCS(C)(=O)=O)C(=O)Nc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C13H16Cl2N2O4S/c1-8(18)16-11(5-6-22(2,20)21)13(19)17-12-7-9(14)3-4-10(12)15/h3-4,7,11H,5-6H2,1-2H3,(H,16,18)(H,17,19)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30970
PNG
(2-ethylsulfanylethyl 4-(1,3-benzodioxol-5-yl)-6-me...)
Show SMILES CCSCCOC(=O)C1C(NC(=O)N=C1C)c1ccc2OCOc2c1
Show InChI InChI=1S/C17H20N2O5S/c1-3-25-7-6-22-16(20)14-10(2)18-17(21)19-15(14)11-4-5-12-13(8-11)24-9-23-12/h4-5,8,14-15H,3,6-7,9H2,1-2H3,(H,19,21)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30981
PNG
((2,5-dimethoxyphenyl)-(4-piperidin-1-ylcarbonylphe...)
Show SMILES COc1ccc(OC)c(c1)C(=O)c1ccc(cc1)C(=O)N1CCCCC1
Show InChI InChI=1S/C21H23NO4/c1-25-17-10-11-19(26-2)18(14-17)20(23)15-6-8-16(9-7-15)21(24)22-12-4-3-5-13-22/h6-11,14H,3-5,12-13H2,1-2H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30664
PNG
(2-Imino-1-(3-methoxy-propyl)-10-oxo-1,10-dihydro-2...)
Show SMILES COCCCn1c2nc3ccccn3c(=O)c2cc(C(=O)NCC2CCCO2)c1=N
Show InChI InChI=1S/C21H25N5O4/c1-29-10-5-9-26-18(22)15(20(27)23-13-14-6-4-11-30-14)12-16-19(26)24-17-7-2-3-8-25(17)21(16)28/h2-3,7-8,12,14,22H,4-6,9-11,13H2,1H3,(H,23,27)
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n/an/an/an/a 4.20E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30684
PNG
(5-(4-Methoxy-phenyl)-7-trifluoromethyl-4,5,6,7-tet...)
Show SMILES COc1ccc(cc1)C1CC(n2nc(cc2N1)C(=O)NCCN1CCOCC1)C(F)(F)F
Show InChI InChI=1S/C21H26F3N5O3/c1-31-15-4-2-14(3-5-15)16-12-18(21(22,23)24)29-19(26-16)13-17(27-29)20(30)25-6-7-28-8-10-32-11-9-28/h2-5,13,16,18,26H,6-12H2,1H3,(H,25,30)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30685
PNG
(1,3-benzodioxol-5-yl-(3-benzyl-5-cyclopropyl-triaz...)
Show SMILES C(c1ccccc1)n1nnc2c(Nc3ccc4OCOc4c3)nc(nc12)C1CC1
Show InChI InChI=1S/C21H18N6O2/c1-2-4-13(5-3-1)11-27-21-18(25-26-27)20(23-19(24-21)14-6-7-14)22-15-8-9-16-17(10-15)29-12-28-16/h1-5,8-10,14H,6-7,11-12H2,(H,22,23,24)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30705
PNG
(CHEMBL744 | MLS000069369 | RILUZOLE | SMR000058231...)
Show SMILES Nc1nc2ccc(OC(F)(F)F)cc2s1
Show InChI InChI=1S/C8H5F3N2OS/c9-8(10,11)14-4-1-2-5-6(3-4)15-7(12)13-5/h1-3H,(H2,12,13)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30713
PNG
((4-amino-6-isopropenyl-s-triazin-2-yl)amine | 6-(1...)
Show SMILES CC(=C)c1nc(N)nc(N)n1
Show InChI InChI=1S/C6H9N5/c1-3(2)4-9-5(7)11-6(8)10-4/h1H2,2H3,(H4,7,8,9,10,11)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30721
PNG
(6-chloranyl-4-phenyl-2-piperazin-1-yl-quinazoline ...)
Show SMILES Clc1ccc2nc(nc(-c3ccccc3)c2c1)N1CCNCC1
Show InChI InChI=1S/C18H17ClN4/c19-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)22-18(21-16)23-10-8-20-9-11-23/h1-7,12,20H,8-11H2
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n/an/an/an/a 1.75E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30746
PNG
(1-[4,6-bis(p-anisidino)-s-triazin-2-yl]-4,5-dimeth...)
Show SMILES COc1ccc(Nc2nc(Nc3ccc(OC)cc3)nc(n2)-n2[nH]c(=O)c(C)c2C)cc1
Show InChI InChI=1S/C22H23N7O3/c1-13-14(2)29(28-19(13)30)22-26-20(23-15-5-9-17(31-3)10-6-15)25-21(27-22)24-16-7-11-18(32-4)12-8-16/h5-12H,1-4H3,(H,28,30)(H2,23,24,25,26,27)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30755
PNG
(2-amino-N-cyclopentyl-1-(2-oxolanylmethyl)-3-pyrro...)
Show SMILES Nc1c(C(=O)NC2CCCC2)c2nc3ccccc3nc2n1CC1CCCO1
Show InChI InChI=1S/C21H25N5O2/c22-19-17(21(27)23-13-6-1-2-7-13)18-20(26(19)12-14-8-5-11-28-14)25-16-10-4-3-9-15(16)24-18/h3-4,9-10,13-14H,1-2,5-8,11-12,22H2,(H,23,27)
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n/an/an/an/a 1.10E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30767
PNG
(3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-metho...)
Show SMILES COC(=O)c1[nH]c2cc(OC)ccc2c1NC(=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C19H16N2O6/c1-24-11-4-5-12-13(8-11)20-17(19(23)25-2)16(12)21-18(22)10-3-6-14-15(7-10)27-9-26-14/h3-8,20H,9H2,1-2H3,(H,21,22)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30801
PNG
(4-(7-hydroxy-2-methyl-4-oxo-1-benzopyran-3-yl)-5-m...)
Show SMILES COC(=O)c1cc(c(C)o1)-c1c(C)oc2cc(O)ccc2c1=O
Show InChI InChI=1S/C17H14O6/c1-8-12(7-14(22-8)17(20)21-3)15-9(2)23-13-6-10(18)4-5-11(13)16(15)19/h4-7,18H,1-3H3
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30804
PNG
(2-[[2-(2-cyanoanilino)-2-keto-ethyl]-methyl-amino]...)
Show SMILES CCOc1ccc(NC(=O)CN(C)CC(=O)Nc2ccccc2C#N)cc1OCC
Show InChI InChI=1S/C22H26N4O4/c1-4-29-19-11-10-17(12-20(19)30-5-2)24-21(27)14-26(3)15-22(28)25-18-9-7-6-8-16(18)13-23/h6-12H,4-5,14-15H2,1-3H3,(H,24,27)(H,25,28)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM30823
PNG
(MLS000060464 | SMR000068191 | [2-[(4,6-dimethoxypy...)
Show SMILES COc1cc(OC)nc(NC(=O)COC(=O)C2CCCCC2)n1
Show InChI InChI=1S/C15H21N3O5/c1-21-12-8-13(22-2)18-15(17-12)16-11(19)9-23-14(20)10-6-4-3-5-7-10/h8,10H,3-7,9H2,1-2H3,(H,16,17,18,19)
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n/an/an/an/a 9.90E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 346 total )  |  Next  |  Last  >>
* indicates data uncertainty>20%