Compile Data Set for Download or QSAR

Found 16 hits Enz. Inhib. hit(s) with all data for entry = 50027978   

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
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247862 (5Z-(9S,11R,15S)-13-Oxa-17-(3-trifluoromethyl)pheny...) Show SMILES O[C@@H](CCc1cccc(c1)C(F)(F)F)CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C23H31F3O6/c24-23(25,26)16-7-5-6-15(12-16)10-11-17(27)14-32-22-18(19(28)13-20(22)29)8-3-1-2-4-9-21(30)31/h1,3,5-7,12,17-20,22,27-29H,2,4,8-11,13-14H2,(H,30,31)/b3-1-/t17-,18-,19-,20+,22+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247917 (5Z-(9S,11R,15S)-13-Oxa-16-phenoxy-propoxy]-9,11,15...) Show SMILES O[C@@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1ccccc1 |r| Show InChI InChI=1S/C21H30O7/c22-15(13-27-16-8-4-3-5-9-16)14-28-21-17(18(23)12-19(21)24)10-6-1-2-7-11-20(25)26/h1,3-6,8-9,15,17-19,21-24H,2,7,10-14H2,(H,25,26)/b6-1-/t15-,17+,18+,19-,21-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50423647 (LANATOPROST | Latanoprost | PHXA-41 | PHXA41 | XA-...) Show SMILES CC(C)OC(=O)CCC\C=C/C[C@@H]1[C@H](O)C[C@H](O)[C@H]1CC[C@@H](O)CCc1ccccc1 |r| Show InChI InChI=1S/C26H40O5/c1-19(2)31-26(30)13-9-4-3-8-12-22-23(25(29)18-24(22)28)17-16-21(27)15-14-20-10-6-5-7-11-20/h3,5-8,10-11,19,21-25,27-29H,4,9,12-18H2,1-2H3/b8-3-/t21-,22-,23-,24+,25-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247915 (5Z-(9S,11R,15R)-13-Oxa-16-phenoxy-propoxy]-9,11,15...) Show SMILES O[C@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1ccccc1 |r| Show InChI InChI=1S/C21H30O7/c22-15(13-27-16-8-4-3-5-9-16)14-28-21-17(18(23)12-19(21)24)10-6-1-2-7-11-20(25)26/h1,3-6,8-9,15,17-19,21-24H,2,7,10-14H2,(H,25,26)/b6-1-/t15-,17-,18-,19+,21+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247863 (5Z-(9S,11R,15R)-13-Oxa-17-(3-trifluoromethyl)pheny...) Show SMILES O[C@H](CCc1cccc(c1)C(F)(F)F)CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C23H31F3O6/c24-23(25,26)16-7-5-6-15(12-16)10-11-17(27)14-32-22-18(19(28)13-20(22)29)8-3-1-2-4-9-21(30)31/h1,3,5-7,12,17-20,22,27-29H,2,4,8-11,13-14H2,(H,30,31)/b3-1-/t17-,18+,19+,20-,22-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50035622 ((5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,...) Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247918 (5Z-(9S,11R,15S)-13-Oxa-16-(3-chloro)phenoxy-propox...) Show SMILES O[C@@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1cccc(Cl)c1 |r| Show InChI InChI=1S/C21H29ClO7/c22-14-6-5-7-16(10-14)28-12-15(23)13-29-21-17(18(24)11-19(21)25)8-3-1-2-4-9-20(26)27/h1,3,5-7,10,15,17-19,21,23-25H,2,4,8-9,11-13H2,(H,26,27)/b3-1-/t15-,17+,18+,19-,21-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (BOVINE)	BDBM50247916 (5Z-(9S,11R,15R)-13-Oxa-16-(3-chloro)phenoxy-propox...) Show SMILES O[C@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1cccc(Cl)c1 |r| Show InChI InChI=1S/C21H29ClO7/c22-14-6-5-7-16(10-14)28-12-15(23)13-29-21-17(18(24)11-19(21)25)8-3-1-2-4-9-20(26)27/h1,3,5-7,10,15,17-19,21,23-25H,2,4,8-9,11-13H2,(H,26,27)/b3-1-/t15-,17-,18-,19+,21+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50035622 ((5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,...) Show SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	24.5	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247918 (5Z-(9S,11R,15S)-13-Oxa-16-(3-chloro)phenoxy-propox...) Show SMILES O[C@@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1cccc(Cl)c1 |r| Show InChI InChI=1S/C21H29ClO7/c22-14-6-5-7-16(10-14)28-12-15(23)13-29-21-17(18(24)11-19(21)25)8-3-1-2-4-9-20(26)27/h1,3,5-7,10,15,17-19,21,23-25H,2,4,8-9,11-13H2,(H,26,27)/b3-1-/t15-,17+,18+,19-,21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	62.2	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247917 (5Z-(9S,11R,15S)-13-Oxa-16-phenoxy-propoxy]-9,11,15...) Show SMILES O[C@@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1ccccc1 |r| Show InChI InChI=1S/C21H30O7/c22-15(13-27-16-8-4-3-5-9-16)14-28-21-17(18(23)12-19(21)24)10-6-1-2-7-11-20(25)26/h1,3-6,8-9,15,17-19,21-24H,2,7,10-14H2,(H,25,26)/b6-1-/t15-,17+,18+,19-,21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	68.6	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247916 (5Z-(9S,11R,15R)-13-Oxa-16-(3-chloro)phenoxy-propox...) Show SMILES O[C@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1cccc(Cl)c1 |r| Show InChI InChI=1S/C21H29ClO7/c22-14-6-5-7-16(10-14)28-12-15(23)13-29-21-17(18(24)11-19(21)25)8-3-1-2-4-9-20(26)27/h1,3,5-7,10,15,17-19,21,23-25H,2,4,8-9,11-13H2,(H,26,27)/b3-1-/t15-,17-,18-,19+,21+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	52.4	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247915 (5Z-(9S,11R,15R)-13-Oxa-16-phenoxy-propoxy]-9,11,15...) Show SMILES O[C@H](CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)COc1ccccc1 |r| Show InChI InChI=1S/C21H30O7/c22-15(13-27-16-8-4-3-5-9-16)14-28-21-17(18(23)12-19(21)24)10-6-1-2-7-11-20(25)26/h1,3-6,8-9,15,17-19,21-24H,2,7,10-14H2,(H,25,26)/b6-1-/t15-,17-,18-,19+,21+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	294	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247863 (5Z-(9S,11R,15R)-13-Oxa-17-(3-trifluoromethyl)pheny...) Show SMILES O[C@H](CCc1cccc(c1)C(F)(F)F)CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C23H31F3O6/c24-23(25,26)16-7-5-6-15(12-16)10-11-17(27)14-32-22-18(19(28)13-20(22)29)8-3-1-2-4-9-21(30)31/h1,3,5-7,12,17-20,22,27-29H,2,4,8-11,13-14H2,(H,30,31)/b3-1-/t17-,18+,19+,20-,22-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.70	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50247862 (5Z-(9S,11R,15S)-13-Oxa-17-(3-trifluoromethyl)pheny...) Show SMILES O[C@@H](CCc1cccc(c1)C(F)(F)F)CO[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O |r| Show InChI InChI=1S/C23H31F3O6/c24-23(25,26)16-7-5-6-15(12-16)10-11-17(27)14-32-22-18(19(28)13-20(22)29)8-3-1-2-4-9-21(30)31/h1,3,5-7,12,17-20,22,27-29H,2,4,8-11,13-14H2,(H,30,31)/b3-1-/t17-,18-,19-,20+,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.90	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair
Prostaglandin F2-alpha receptor (MOUSE)	BDBM50423647 (LANATOPROST | Latanoprost | PHXA-41 | PHXA41 | XA-...) Show SMILES CC(C)OC(=O)CCC\C=C/C[C@@H]1[C@H](O)C[C@H](O)[C@H]1CC[C@@H](O)CCc1ccccc1 |r| Show InChI InChI=1S/C26H40O5/c1-19(2)31-26(30)13-9-4-3-8-12-22-23(25(29)18-24(22)28)17-16-21(27)15-14-20-10-6-5-7-11-20/h3,5-8,10-11,19,21-25,27-29H,4,9,12-18H2,1-2H3/b8-3-/t21-,22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	32	n/a	n/a	n/a	n/a
Alcon Research Ltd. Curated by ChEMBL					Assay Description Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP accumulation by scintillation counting				Bioorg Med Chem 17: 576-84 (2009) Article DOI: 10.1016/j.bmc.2008.11.070 BindingDB Entry DOI: 10.7270/Q2RJ4JC1
					More data for this Ligand-Target Pair