Compile Data Set for Download or QSAR

Found 11 hits of ic50 for UniProtKB: P35563   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
5-hydroxytryptamine receptor 3A (RAT)	BDBM85330 (CAS_68647 | NSC_68647 | ONDANSETRON | Ondansetron ...) Show SMILES Cc1nccn1CC1CCc2c(C1=O)c1ccccc1n2C Show InChI InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	0.160	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S Curated by ChEMBL					Assay Description Binding affinity to rat 5HT3A receptor				J Med Chem 54: 3206-21 (2011) Article DOI: 10.1021/jm101459g BindingDB Entry DOI: 10.7270/Q2W37XFC
					More data for this Ligand-Target Pair				3D Structure (crystal)
5-hydroxytryptamine receptor 3A (RAT)	BDBM50400902 (1-(2-(2,4-dimethylphenylsulfanyl)phenyl)piperazine...) Show SMILES Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1 Show InChI InChI=1S/C18H22N2S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	0.180	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S Curated by ChEMBL					Assay Description Binding affinity to rat 5HT3A receptor				J Med Chem 54: 3206-21 (2011) Article DOI: 10.1021/jm101459g BindingDB Entry DOI: 10.7270/Q2W37XFC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50060686 (4-(4-Methyl-piperazin-1-yl)-pyrrolo[1,2-a]quinolin...) Show SMILES CN1CCN(CC1)c1nc2ccccc2n2cccc12 Show InChI InChI=1S/C16H18N4/c1-18-9-11-19(12-10-18)16-15-7-4-8-20(15)14-6-3-2-5-13(14)17-16/h2-8H,9-12H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.370	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of [3H]-BRL 43694 from 5-HT3 receptor in rat cortex membrane incubated for 30 mins by liquid scintillation counting method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00224 BindingDB Entry DOI: 10.7270/Q2X3528B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50081981 (4-(4-Benzyl-piperazin-1-yl)-9-methyl-pyrrolo[1,2-a...) Show SMILES Cc1cccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c12 Show InChI InChI=1S/C23H24N4/c1-18-7-5-10-20-22(18)27-12-6-11-21(27)23(24-20)26-15-13-25(14-16-26)17-19-8-3-2-4-9-19/h2-12H,13-17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80	n/a	n/a	n/a	n/a	n/a	n/a
European Research Centre for Drug Discovery and Development Curated by ChEMBL					Assay Description Displacement of [3H]LY278584 from 5HT3 receptor in rat cortical homogenate				J Med Chem 52: 6946-50 (2009) Article DOI: 10.1021/jm901126m BindingDB Entry DOI: 10.7270/Q2H9963M
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50081974 (4-(4-Benzyl-piperazin-1-yl)-7-fluoro-pyrrolo[1,2-a...) Show SMILES Fc1ccc2c(c1)nc(N1CCN(Cc3ccccc3)CC1)c1cccn21 Show InChI InChI=1S/C22H21FN4/c23-18-8-9-20-19(15-18)24-22(21-7-4-10-27(20)21)26-13-11-25(12-14-26)16-17-5-2-1-3-6-17/h1-10,15H,11-14,16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
European Research Centre for Drug Discovery and Development Curated by ChEMBL					Assay Description Displacement of [3H]LY278584 from 5HT3 receptor in rat cortical homogenate				J Med Chem 52: 6946-50 (2009) Article DOI: 10.1021/jm901126m BindingDB Entry DOI: 10.7270/Q2H9963M
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50304334 (3alpha-(1'-Methyl-2'-Indolecarbonyloxy)-tropane | ...) Show SMILES CN1[C@@H]2CC[C@@H]1CC(C2)OC(=O)c1cc2ccccc2n1C |r,THB:9:7:1:3.4| Show InChI InChI=1S/C18H22N2O2/c1-19-13-7-8-14(19)11-15(10-13)22-18(21)17-9-12-5-3-4-6-16(12)20(17)2/h3-6,9,13-15H,7-8,10-11H2,1-2H3/t13-,14-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]granisectron from 5HT3 receptor in Wistar rat forebrain				Bioorg Med Chem 17: 6872-8 (2009) Article DOI: 10.1016/j.bmc.2009.08.029 BindingDB Entry DOI: 10.7270/Q2DJ5FQJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50304335 (3alpha-(1'-Methyl-2'-Indolecarbonyloxy)-nortropane...) Show SMILES Cn1c(cc2ccccc12)C(=O)OC1C[C@H]2CC[C@H](C1)N2 |r,TLB:12:13:20:16.17| Show InChI InChI=1S/C17H20N2O2/c1-19-15-5-3-2-4-11(15)8-16(19)17(20)21-14-9-12-6-7-13(10-14)18-12/h2-5,8,12-14,18H,6-7,9-10H2,1H3/t12-,13-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]granisectron from 5HT3 receptor in Wistar rat forebrain				Bioorg Med Chem 17: 6872-8 (2009) Article DOI: 10.1016/j.bmc.2009.08.029 BindingDB Entry DOI: 10.7270/Q2DJ5FQJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50304333 (3alpha-(2'-Indolecarbonyloxy)-nortropane | CHEMBL5...) Show SMILES O=C(OC1C[C@H]2CC[C@H](C1)N2)c1cc2ccccc2[nH]1 |r,TLB:2:3:10:6.7| Show InChI InChI=1S/C16H18N2O2/c19-16(15-7-10-3-1-2-4-14(10)18-15)20-13-8-11-5-6-12(9-13)17-11/h1-4,7,11-13,17-18H,5-6,8-9H2/t11-,12-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]granisectron from 5HT3 receptor in Wistar rat forebrain				Bioorg Med Chem 17: 6872-8 (2009) Article DOI: 10.1016/j.bmc.2009.08.029 BindingDB Entry DOI: 10.7270/Q2DJ5FQJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50421348 (CHEMBL18710) Show SMILES CN(C)CCc1coc2ccc(cc12)C(N)=O Show InChI InChI=1S/C13H16N2O2/c1-15(2)6-5-10-8-17-12-4-3-9(13(14)16)7-11(10)12/h3-4,7-8H,5-6H2,1-2H3,(H2,14,16)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In Vitro Binding affinity againist 5-hydroxytryptamine 3 receptor by displacing [3H]-Q-ICS 205-930 from rat cortex homogenates				Bioorg Med Chem Lett 4: 1207-1212 (1994) Article DOI: 10.1016/S0960-894X(01)80331-0 BindingDB Entry DOI: 10.7270/Q2TH8P0J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50421347 (CHEMBL18928) Show SMILES NCCC1COc2ccc(cc12)C(N)=O Show InChI InChI=1S/C11H14N2O2/c12-4-3-8-6-15-10-2-1-7(11(13)14)5-9(8)10/h1-2,5,8H,3-4,6,12H2,(H2,13,14)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	4.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In Vitro Binding affinity againist 5-hydroxytryptamine 3 receptor by displacing [3H]-Q-ICS 205-930 from rat cortex homogenates				Bioorg Med Chem Lett 4: 1207-1212 (1994) Article DOI: 10.1016/S0960-894X(01)80331-0 BindingDB Entry DOI: 10.7270/Q2TH8P0J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (RAT)	BDBM50421346 (CHEMBL19114) Show SMILES NCCc1coc2ccc(cc12)C(N)=O Show InChI InChI=1S/C11H12N2O2/c12-4-3-8-6-15-10-2-1-7(11(13)14)5-9(8)10/h1-2,5-6H,3-4,12H2,(H2,13,14)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	7.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In Vitro Binding affinity againist 5-hydroxytryptamine 3 receptor by displacing [3H]-Q-ICS 205-930 from rat cortex homogenates				Bioorg Med Chem Lett 4: 1207-1212 (1994) Article DOI: 10.1016/S0960-894X(01)80331-0 BindingDB Entry DOI: 10.7270/Q2TH8P0J
					More data for this Ligand-Target Pair