Found 110 hits with Last Name = 'reilly' and Initial = 'je' 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 |
|---|
Estrogen receptor beta
(Homo sapiens (Human)) | BDBM19968
((2R,6S,7R)-7-(4-hydroxyphenyl)-8-oxatricyclo[7.4.0...)Show SMILES Oc1ccc(cc1)[C@@H]1Oc2ccc(O)cc2[C@@H]2CCC[C@H]12 |r| Show InChI InChI=1S/C18H18O3/c19-12-6-4-11(5-7-12)18-15-3-1-2-14(15)16-10-13(20)8-9-17(16)21-18/h4-10,14-15,18-20H,1-3H2/t14-,15+,18+/m1/s1 | PDB
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| PDB
Article
PubMed
| 0.170 | -55.2 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Estrogen receptor beta
(Homo sapiens (Human)) | BDBM19986
((2R,6S,7R)-7-(4-hydroxyphenyl)-10-methyl-8-oxatric...)Show SMILES Cc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C19H20O3/c1-11-9-14(21)10-17-15-3-2-4-16(15)19(22-18(11)17)12-5-7-13(20)8-6-12/h5-10,15-16,19-21H,2-4H2,1H3/t15-,16+,19+/m1/s1 | PDB
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| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.260 | -54.2 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
Estrogen receptor beta
(Homo sapiens (Human)) | BDBM19987
((2R,6S,7R)-7-(4-hydroxyphenyl)-10-(methoxymethyl)-...)Show SMILES COCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C20H22O4/c1-23-11-13-9-15(22)10-18-16-3-2-4-17(16)19(24-20(13)18)12-5-7-14(21)8-6-12/h5-10,16-17,19,21-22H,2-4,11H2,1H3/t16-,17+,19+/m1/s1 | PDB
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| PDB
Article
PubMed
| 0.280 | -54.0 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Estrogen receptor beta
(Homo sapiens (Human)) | BDBM19988
((2R,6S,7R)-10-(ethoxymethyl)-7-(4-hydroxyphenyl)-8...)Show SMILES CCOCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C21H24O4/c1-2-24-12-14-10-16(23)11-19-17-4-3-5-18(17)20(25-21(14)19)13-6-8-15(22)9-7-13/h6-11,17-18,20,22-23H,2-5,12H2,1H3/t17-,18+,20+/m1/s1 | PDB
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| 0.745 | -51.6 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50130461
(4-Fluoro-N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-...)Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12-14,23H,8-11H2,1H3,(H,24,26) | PDB
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| Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156407
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indol-6...)Show SMILES CN1CCC(CC1)n1ccc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-8,13-14,19H,9-12H2,1H3,(H,23,26) | PDB
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UniChem
| Article
PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Estrogen receptor
(Homo sapiens (Human)) | BDBM19968
((2R,6S,7R)-7-(4-hydroxyphenyl)-8-oxatricyclo[7.4.0...)Show SMILES Oc1ccc(cc1)[C@@H]1Oc2ccc(O)cc2[C@@H]2CCC[C@H]12 |r| Show InChI InChI=1S/C18H18O3/c19-12-6-4-11(5-7-12)18-15-3-1-2-14(15)16-10-13(20)8-9-17(16)21-18/h4-10,14-15,18-20H,1-3H2/t14-,15+,18+/m1/s1 | PDB
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PubMed
| 2.29 | -48.8 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Estrogen receptor
(Homo sapiens (Human)) | BDBM19986
((2R,6S,7R)-7-(4-hydroxyphenyl)-10-methyl-8-oxatric...)Show SMILES Cc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C19H20O3/c1-11-9-14(21)10-17-15-3-2-4-16(15)19(22-18(11)17)12-5-7-13(20)8-6-12/h5-10,15-16,19-21H,2-4H2,1H3/t15-,16+,19+/m1/s1 | PDB
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| Article
PubMed
| 2.82 | -48.3 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156409
(2-Chloro-4-fluoro-N-[3-(1-methyl-piperidin-4-yl)-b...)Show SMILES CN1CCC(CC1)c1noc2ccc(NC(=O)c3ccc(F)cc3Cl)cc12 Show InChI InChI=1S/C20H19ClFN3O2/c1-25-8-6-12(7-9-25)19-16-11-14(3-5-18(16)27-24-19)23-20(26)15-4-2-13(22)10-17(15)21/h2-5,10-12H,6-9H2,1H3,(H,23,26) | PDB
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| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156410
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)c1n[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-25-10-8-13(9-11-25)19-17-12-16(6-7-18(17)23-24-19)22-20(26)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,26)(H,23,24) | PDB
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| Article
PubMed
| 3.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156411
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)n1ncc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-24-10-8-18(9-11-24)25-19-12-17(7-4-15(19)13-22-25)23-20(26)14-2-5-16(21)6-3-14/h2-7,12-13,18H,8-11H2,1H3,(H,23,26) | PDB
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| CHEMBL
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UniChem
| Article
PubMed
| 4.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156404
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)N1CCc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-7,14,19H,8-13H2,1H3,(H,23,26) | PDB
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UniChem
| Article
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| 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Estrogen receptor beta
(Homo sapiens (Human)) | BDBM19989
((2R,6S,7R)-10-(hydroxymethyl)-7-(4-hydroxyphenyl)-...)Show SMILES OCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C19H20O4/c20-10-12-8-14(22)9-17-15-2-1-3-16(15)18(23-19(12)17)11-4-6-13(21)7-5-11/h4-9,15-16,18,20-22H,1-3,10H2/t15-,16+,18+/m1/s1 | PDB
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| PC cid
PC sid
UniChem
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| Article
PubMed
| 5.97 | -46.5 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
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PC sid
UniChem
| Article
PubMed
| 8.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
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| 9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
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| Article
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| 9.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156407
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indol-6...)Show SMILES CN1CCC(CC1)n1ccc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-8,13-14,19H,9-12H2,1H3,(H,23,26) | PDB
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Estrogen receptor
(Homo sapiens (Human)) | BDBM19987
((2R,6S,7R)-7-(4-hydroxyphenyl)-10-(methoxymethyl)-...)Show SMILES COCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C20H22O4/c1-23-11-13-9-15(22)10-18-16-3-2-4-17(16)19(24-20(13)18)12-5-7-14(21)8-6-12/h5-10,16-17,19,21-22H,2-4,11H2,1H3/t16-,17+,19+/m1/s1 | PDB
UniProtKB/SwissProt
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PDB
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Patents
Similars
| PDB
Article
PubMed
| 11 | -45.0 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156404
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)N1CCc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-7,14,19H,8-13H2,1H3,(H,23,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156406
(2,4-Difluoro-N-[3-(1-methyl-piperidin-4-yl)-benzo[...)Show SMILES CN1CCC(CC1)c1noc2ccc(NC(=O)c3ccc(F)cc3F)cc12 Show InChI InChI=1S/C20H19F2N3O2/c1-25-8-6-12(7-9-25)19-16-11-14(3-5-18(16)27-24-19)23-20(26)15-4-2-13(21)10-17(15)22/h2-5,10-12H,6-9H2,1H3,(H,23,26) | PDB
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| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156403
(2-Chloro-4-fluoro-N-[3-(1-methyl-piperidin-4-yl)-2...)Show SMILES CN1CCC(CC1)N1CNc2ccc(NC(=O)c3ccc(F)cc3Cl)cc12 Show InChI InChI=1S/C20H22ClFN4O/c1-25-8-6-15(7-9-25)26-12-23-18-5-3-14(11-19(18)26)24-20(27)16-4-2-13(22)10-17(16)21/h2-5,10-11,15,23H,6-9,12H2,1H3,(H,24,27) | PDB
Reactome pathway
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| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156408
(2,4,6-Trifluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3...)Show SMILES CN1CCC(CC1)N1CNc2ccc(NC(=O)c3c(F)cc(F)cc3F)cc12 Show InChI InChI=1S/C20H21F3N4O/c1-26-6-4-14(5-7-26)27-11-24-17-3-2-13(10-18(17)27)25-20(28)19-15(22)8-12(21)9-16(19)23/h2-3,8-10,14,24H,4-7,11H2,1H3,(H,25,28) | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156412
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-benzo[d]is...)Show SMILES CN1CCC(CC1)c1noc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H20FN3O2/c1-24-10-8-13(9-11-24)19-17-12-16(6-7-18(17)26-23-19)22-20(25)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,25) | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50130461
(4-Fluoro-N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-...)Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12-14,23H,8-11H2,1H3,(H,24,26) | PDB
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Estrogen receptor
(Homo sapiens (Human)) | BDBM19988
((2R,6S,7R)-10-(ethoxymethyl)-7-(4-hydroxyphenyl)-8...)Show SMILES CCOCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C21H24O4/c1-2-24-12-14-10-16(23)11-19-17-4-3-5-18(17)20(25-21(14)19)13-6-8-15(22)9-7-13/h6-11,17-18,20,22-23H,2-5,12H2,1H3/t17-,18+,20+/m1/s1 | PDB
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| 27.2 | -42.7 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50156407
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indol-6...)Show SMILES CN1CCC(CC1)n1ccc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-8,13-14,19H,9-12H2,1H3,(H,23,26) | PDB
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| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Estrogen receptor
(Homo sapiens (Human)) | BDBM19989
((2R,6S,7R)-10-(hydroxymethyl)-7-(4-hydroxyphenyl)-...)Show SMILES OCc1cc(O)cc2[C@@H]3CCC[C@@H]3[C@@H](Oc12)c1ccc(O)cc1 |r| Show InChI InChI=1S/C19H20O4/c20-10-12-8-14(22)9-17-15-2-1-3-16(15)18(23-19(12)17)11-4-6-13(21)7-5-11/h4-9,15-16,18,20-22H,1-3,10H2/t15-,16+,18+/m1/s1 | PDB
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| 147 | -38.6 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Lilly Research Laboratories
| Assay Description
The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin... |
Bioorg Med Chem Lett 17: 5082-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.07.009
BindingDB Entry DOI: 10.7270/Q27S7M2Q |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156412
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-benzo[d]is...)Show SMILES CN1CCC(CC1)c1noc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H20FN3O2/c1-24-10-8-13(9-11-24)19-17-12-16(6-7-18(17)26-23-19)22-20(25)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,25) | PDB
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| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50156404
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)N1CCc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-7,14,19H,8-13H2,1H3,(H,23,26) | PDB
Reactome pathway
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| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50130461
(4-Fluoro-N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-...)Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12-14,23H,8-11H2,1H3,(H,24,26) | PDB
Reactome pathway
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| 240 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1B receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
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| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
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| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50156407
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indol-6...)Show SMILES CN1CCC(CC1)n1ccc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-8,13-14,19H,9-12H2,1H3,(H,23,26) | PDB
Reactome pathway
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| 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1B receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156411
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)n1ncc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-24-10-8-18(9-11-24)25-19-12-17(7-4-15(19)13-22-25)23-20(26)14-2-5-16(21)6-3-14/h2-7,12-13,18H,8-11H2,1H3,(H,23,26) | PDB
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| 310 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50130461
(4-Fluoro-N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-...)Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H22FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12-14,23H,8-11H2,1H3,(H,24,26) | PDB
Reactome pathway
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| 430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50156404
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)N1CCc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-24-11-9-19(10-12-24)25-13-8-15-4-7-18(14-20(15)25)23-21(26)16-2-5-17(22)6-3-16/h2-7,14,19H,8-13H2,1H3,(H,23,26) | PDB
Reactome pathway
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| 440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1B receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1F
(Homo sapiens (Human)) | BDBM50156405
(4-Fluoro-N-[4-(1-methyl-piperidin-4-yl)-3,4-dihydr...)Show SMILES CN1CCC(CC1)N1CCOc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O2/c1-24-10-8-18(9-11-24)25-12-13-27-20-7-6-17(14-19(20)25)23-21(26)15-2-4-16(22)5-3-15/h2-7,14,18H,8-13H2,1H3,(H,23,26) | PDB
Reactome pathway
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| 520 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1F receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156405
(4-Fluoro-N-[4-(1-methyl-piperidin-4-yl)-3,4-dihydr...)Show SMILES CN1CCC(CC1)N1CCOc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O2/c1-24-10-8-18(9-11-24)25-12-13-27-20-7-6-17(14-19(20)25)23-21(26)15-2-4-16(22)5-3-15/h2-7,14,18H,8-13H2,1H3,(H,23,26) | PDB
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| 860 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50156410
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)c1n[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-25-10-8-13(9-11-25)19-17-12-16(6-7-18(17)23-24-19)22-20(26)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,26)(H,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 870 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1A receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50156402
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-2,3-dihydr...)Show SMILES CN1CCC(CC1)C1CNc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15/h2-7,12,14,19,23H,8-11,13H2,1H3,(H,24,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50156410
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)c1n[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-25-10-8-13(9-11-25)19-17-12-16(6-7-18(17)23-24-19)22-20(26)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,26)(H,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1B receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50156405
(4-Fluoro-N-[4-(1-methyl-piperidin-4-yl)-3,4-dihydr...)Show SMILES CN1CCC(CC1)N1CCOc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C21H24FN3O2/c1-24-10-8-18(9-11-24)25-12-13-27-20-7-6-17(14-19(20)25)23-21(26)15-2-4-16(22)5-3-15/h2-7,14,18H,8-13H2,1H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50156411
(4-Fluoro-N-[1-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)n1ncc2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-24-10-8-18(9-11-24)25-19-12-17(7-4-15(19)13-22-25)23-20(26)14-2-5-16(21)6-3-14/h2-7,12-13,18H,8-11H2,1H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1B receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50156410
(4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol...)Show SMILES CN1CCC(CC1)c1n[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12 Show InChI InChI=1S/C20H21FN4O/c1-25-10-8-13(9-11-25)19-17-12-16(6-7-18(17)23-24-19)22-20(26)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,22,26)(H,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by ChEMBL
| Assay Description
In vitro binding affinity for human 5-hydroxytryptamine 1D receptor |
Bioorg Med Chem Lett 14: 6011-6 (2004)
Article DOI: 10.1016/j.bmcl.2004.09.079
BindingDB Entry DOI: 10.7270/Q23J3CFK |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475107
(CHEMBL179928)Show InChI InChI=1S/C13H8Cl3NO3S/c14-8-1-4-10(5-2-8)21(19,20)17-13(18)11-6-3-9(15)7-12(11)16/h1-7H,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475105
(CHEMBL189605)Show InChI InChI=1S/C13H8BrCl2NO3S/c14-8-1-6-11(12(16)7-8)13(18)17-21(19,20)10-4-2-9(15)3-5-10/h1-7H,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475147
(CHEMBL185804)Show InChI InChI=1S/C14H11Cl2NO3S/c1-9-2-5-11(6-3-9)21(19,20)17-14(18)12-7-4-10(15)8-13(12)16/h2-8H,1H3,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475104
(CHEMBL362085)Show InChI InChI=1S/C13H8BrCl2NO3S/c14-12-7-9(16)3-6-11(12)13(18)17-21(19,20)10-4-1-8(15)2-5-10/h1-7H,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475152
(CHEMBL188975)Show SMILES Clc1ccc(C(=O)NS(=O)(=O)c2ccc(Br)cc2)c(Cl)c1 Show InChI InChI=1S/C13H8BrCl2NO3S/c14-8-1-4-10(5-2-8)21(19,20)17-13(18)11-6-3-9(15)7-12(11)16/h1-7H,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
Vascular endothelial growth factor receptor 1/2/3
(Homo sapiens (Human)) | BDBM50475145
(CHEMBL187453)Show InChI InChI=1S/C13H8Br2ClNO3S/c14-8-1-6-11(12(15)7-8)13(18)17-21(19,20)10-4-2-9(16)3-5-10/h1-7H,(H,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Eli Lilly and Company
Curated by ChEMBL
| Assay Description
Inhibition of vascular endothelial growth factor (VEGF)-stimulated human umbilical vein endothelial cell proliferation |
J Med Chem 47: 5367-80 (2004)
Article DOI: 10.1021/jm030594r
BindingDB Entry DOI: 10.7270/Q2QR50W8 |
More data for this
Ligand-Target Pair | |
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