Compile Data Set for Download or QSAR

Found 57 hits Enz. Inhib. hit(s) with all data for entry = 50040859   

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 D2 receptor 2 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human CRTH2 receptor				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401116 (CHEMBL2204474) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3cc(F)c(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H17F4N3O3/c1-12-16(17-7-14(24)2-4-21(17)29(12)11-23(32)33)8-15-3-5-22(31)30(28-15)10-13-6-19(26)20(27)9-18(13)25/h2-7,9H,8,10-11H2,1H3,(H,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of CRTH2 receptor-mediated chemotaxis in human basophils				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401108 (CHEMBL2205148) Show SMILES Cc1c(-c2nn(CCOc3ccc(Cl)cc3)c(=O)c3ccccc23)c2cc(Cl)ccc2n1CC(O)=O |(7.71,-8.01,;6.17,-8.01,;5.26,-6.75,;6.03,-5.43,;7.57,-5.44,;8.35,-4.11,;9.89,-4.11,;10.65,-5.45,;12.19,-5.46,;12.96,-6.8,;12.18,-8.12,;12.94,-9.46,;14.48,-9.46,;15.25,-10.8,;15.26,-8.13,;14.49,-6.79,;7.58,-2.77,;8.36,-1.44,;6.04,-2.76,;5.27,-1.43,;3.73,-1.43,;2.96,-2.77,;3.73,-4.1,;5.27,-4.1,;3.78,-7.23,;2.45,-6.47,;1.12,-7.24,;-.22,-6.47,;1.12,-8.79,;2.45,-9.56,;3.78,-8.79,;5.26,-9.26,;5.73,-10.73,;4.7,-11.87,;3.19,-11.56,;5.18,-13.34,)| Show InChI InChI=1S/C27H21Cl2N3O4/c1-16-25(22-14-18(29)8-11-23(22)31(16)15-24(33)34)26-20-4-2-3-5-21(20)27(35)32(30-26)12-13-36-19-9-6-17(28)7-10-19/h2-11,14H,12-13,15H2,1H3,(H,33,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401120 (CHEMBL2204470) Show SMILES Cc1c(CC2=NN(Cc3ccc(F)cc3F)C(=O)CC2)c2cc(F)ccc2n1CC(O)=O |t:4| Show InChI InChI=1S/C23H20F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-4,6,8-9H,5,7,10-12H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401118 (CHEMBL2204472) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(cc3)C(C)(C)O)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C26H26FN3O4/c1-16-21(22-12-19(27)8-10-23(22)29(16)15-25(32)33)13-20-9-11-24(31)30(28-20)14-17-4-6-18(7-5-17)26(2,3)34/h4-12,34H,13-15H2,1-3H3,(H,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401117 (CHEMBL2204473) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccncc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C22H18F2N4O3/c1-13-17(18-8-15(23)2-4-20(18)27(13)12-22(30)31)9-16-3-5-21(29)28(26-16)11-14-6-7-25-10-19(14)24/h2-8,10H,9,11-12H2,1H3,(H,30,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Mus musculus (mouse))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of mouse CRTH2 receptor				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401111 (CHEMBL2204479) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C26H20F7N3O4/c1-14-19(20-10-17(27)6-8-21(20)35(14)13-23(38)39)11-18-7-9-22(37)36(34-18)12-15-2-4-16(5-3-15)24(40,25(28,29)30)26(31,32)33/h2-10,40H,11-13H2,1H3,(H,38,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401122 (CHEMBL2205146) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H20FN3O3/c1-15-19(20-11-17(24)7-9-21(20)26(15)14-23(29)30)12-18-8-10-22(28)27(25-18)13-16-5-3-2-4-6-16/h2-11H,12-14H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401119 (CHEMBL2204471) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C22H16F3N3O3/c1-12-22(16-8-14(23)4-6-19(16)27(12)11-21(30)31)18-5-7-20(29)28(26-18)10-13-2-3-15(24)9-17(13)25/h2-9H,10-11H2,1H3,(H,30,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401124 (CHEMBL2205144) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2cc(F)ccc2n1CC(O)=O |(8.23,-6.54,;6.69,-6.54,;5.77,-5.29,;6.5,-3.93,;8.04,-3.88,;8.76,-2.52,;10.3,-2.47,;11.12,-3.77,;10.39,-5.13,;11.2,-6.43,;12.75,-6.38,;13.47,-5.01,;12.65,-3.71,;7.94,-1.21,;8.66,.16,;6.4,-1.28,;5.59,.03,;4.05,-.04,;3.34,-1.4,;4.16,-2.69,;5.68,-2.63,;4.3,-5.77,;2.96,-5,;1.63,-5.78,;.3,-5,;1.63,-7.32,;2.96,-8.09,;4.3,-7.32,;5.77,-7.8,;6.49,-9.16,;5.67,-10.47,;4.13,-10.41,;6.39,-11.83,)| Show InChI InChI=1S/C26H20FN3O3/c1-16-24(21-13-18(27)11-12-22(21)29(16)15-23(31)32)25-19-9-5-6-10-20(19)26(33)30(28-25)14-17-7-3-2-4-8-17/h2-13H,14-15H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401126 (CHEMBL2204493) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2cc(Cl)ccc2n1CC(O)=O |(23.87,-56.05,;22.33,-56.05,;21.42,-54.8,;22.14,-53.44,;23.68,-53.39,;24.41,-52.03,;25.95,-51.98,;26.76,-53.28,;26.03,-54.64,;26.85,-55.94,;28.39,-55.89,;29.11,-54.52,;28.29,-53.22,;23.59,-50.72,;24.31,-49.36,;22.04,-50.79,;21.23,-49.49,;19.7,-49.55,;18.98,-50.91,;19.8,-52.2,;21.32,-52.14,;19.94,-55.28,;18.61,-54.51,;17.28,-55.28,;15.94,-54.51,;17.27,-56.83,;18.61,-57.6,;19.94,-56.83,;21.42,-57.31,;22.14,-58.67,;21.31,-59.98,;19.77,-59.92,;22.03,-61.34,)| Show InChI InChI=1S/C26H20ClN3O3/c1-16-24(21-13-18(27)11-12-22(21)29(16)15-23(31)32)25-19-9-5-6-10-20(19)26(33)30(28-25)14-17-7-3-2-4-8-17/h2-13H,14-15H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401113 (CHEMBL2204477) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccncc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C22H19FN4O3/c1-14-18(19-10-16(23)2-4-20(19)26(14)13-22(29)30)11-17-3-5-21(28)27(25-17)12-15-6-8-24-9-7-15/h2-10H,11-13H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401115 (CHEMBL2204475) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccccc3)n2)c2cc(Cl)ccc2n1CC(O)=O Show InChI InChI=1S/C23H20ClN3O3/c1-15-19(20-11-17(24)7-9-21(20)26(15)14-23(29)30)12-18-8-10-22(28)27(25-18)13-16-5-3-2-4-6-16/h2-11H,12-14H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401112 (CHEMBL2204478) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(cc3)C(F)(F)F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C24H19F4N3O3/c1-14-19(20-10-17(25)6-8-21(20)30(14)13-23(33)34)11-18-7-9-22(32)31(29-18)12-15-2-4-16(5-3-15)24(26,27)28/h2-10H,11-13H2,1H3,(H,33,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401139 (CHEMBL2205160) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(Br)ccc2n1CC(O)=O Show InChI InChI=1S/C22H18BrN3O3/c1-14-22(17-11-16(23)7-9-19(17)25(14)13-21(28)29)18-8-10-20(27)26(24-18)12-15-5-3-2-4-6-15/h2-11H,12-13H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401106 (CHEMBL2205150) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CC(O)=O |(37.95,-7.39,;36.41,-7.39,;35.5,-6.14,;36.27,-4.81,;37.81,-4.82,;38.59,-3.49,;40.13,-3.5,;40.89,-4.83,;40.11,-6.16,;40.87,-7.49,;42.41,-7.5,;43.19,-6.16,;42.42,-4.83,;37.82,-2.15,;38.6,-.82,;36.28,-2.15,;35.51,-.81,;33.96,-.81,;33.19,-2.16,;33.97,-3.49,;35.51,-3.49,;34.03,-6.62,;32.69,-5.85,;31.36,-6.62,;31.36,-8.17,;32.69,-8.94,;34.03,-8.17,;35.5,-8.65,;35.98,-10.11,;34.95,-11.25,;33.44,-10.94,;35.42,-12.72,)| Show InChI InChI=1S/C26H21N3O3/c1-17-24(21-13-7-8-14-22(21)28(17)16-23(30)31)25-19-11-5-6-12-20(19)26(32)29(27-25)15-18-9-3-2-4-10-18/h2-14H,15-16H2,1H3,(H,30,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401121 (CHEMBL2205147) Show SMILES Cc1c(CC2=NN(Cc3ccccc3)C(=O)CC2)c2cc(F)ccc2n1CC(O)=O |t:4| Show InChI InChI=1S/C23H22FN3O3/c1-15-19(20-11-17(24)7-9-21(20)26(15)14-23(29)30)12-18-8-10-22(28)27(25-18)13-16-5-3-2-4-6-16/h2-7,9,11H,8,10,12-14H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401114 (CHEMBL2204476) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2ccccc2n1CC(O)=O Show InChI InChI=1S/C23H19F2N3O3/c1-14-19(18-4-2-3-5-21(18)27(14)13-23(30)31)11-17-8-9-22(29)28(26-17)12-15-6-7-16(24)10-20(15)25/h2-10H,11-13H2,1H3,(H,30,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401107 (CHEMBL2205149) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccc(F)cc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C22H17F2N3O3/c1-13-22(17-10-16(24)6-8-19(17)26(13)12-21(29)30)18-7-9-20(28)27(25-18)11-14-2-4-15(23)5-3-14/h2-10H,11-12H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401137 (CHEMBL2204483) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C22H18FN3O3/c1-14-22(17-11-16(23)7-9-19(17)25(14)13-21(28)29)18-8-10-20(27)26(24-18)12-15-5-3-2-4-6-15/h2-11H,12-13H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401109 (CHEMBL2204481) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)cc(F)c2n1CC(O)=O Show InChI InChI=1S/C23H17F4N3O3/c1-12-17(18-6-15(25)8-20(27)23(18)29(12)11-22(32)33)9-16-4-5-21(31)30(28-16)10-13-2-3-14(24)7-19(13)26/h2-8H,9-11H2,1H3,(H,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401138 (CHEMBL2204482) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(Cl)ccc2n1CC(O)=O Show InChI InChI=1S/C22H18ClN3O3/c1-14-22(17-11-16(23)7-9-19(17)25(14)13-21(28)29)18-8-10-20(27)26(24-18)12-15-5-3-2-4-6-15/h2-11H,12-13H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401125 (CHEMBL2205143) Show SMILES Cc1c(Cc2nn(Cc3ccccc3)c(=O)c3ccccc23)c2cc(Cl)ccc2n1CC(O)=O Show InChI InChI=1S/C27H22ClN3O3/c1-17-22(23-13-19(28)11-12-25(23)30(17)16-26(32)33)14-24-20-9-5-6-10-21(20)27(34)31(29-24)15-18-7-3-2-4-8-18/h2-13H,14-16H2,1H3,(H,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401110 (CHEMBL2204480) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccccc3)n2)c2ccccc2n1CC(O)=O Show InChI InChI=1S/C23H21N3O3/c1-16-20(19-9-5-6-10-21(19)25(16)15-23(28)29)13-18-11-12-22(27)26(24-18)14-17-7-3-2-4-8-17/h2-12H,13-15H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401136 (CHEMBL2204484) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(C)ccc2n1CC(O)=O Show InChI InChI=1S/C23H21N3O3/c1-15-8-10-20-18(12-15)23(16(2)25(20)14-22(28)29)19-9-11-21(27)26(24-19)13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401130 (CHEMBL2204489) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)cc(F)c2n1CC(O)=O Show InChI InChI=1S/C22H17F2N3O3/c1-13-21(16-9-15(23)10-17(24)22(16)26(13)12-20(29)30)18-7-8-19(28)27(25-18)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	76	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401132 (CHEMBL2204487) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(Cl)cc(F)c2n1CC(O)=O Show InChI InChI=1S/C22H17ClFN3O3/c1-13-21(16-9-15(23)10-17(24)22(16)26(13)12-20(29)30)18-7-8-19(28)27(25-18)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401134 (CHEMBL2203299) Show SMILES COc1ccc2n(CC(O)=O)c(C)c(-c3ccc(=O)n(Cc4ccccc4)n3)c2c1 Show InChI InChI=1S/C23H21N3O4/c1-15-23(18-12-17(30-2)8-10-20(18)25(15)14-22(28)29)19-9-11-21(27)26(24-19)13-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	104	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401123 (CHEMBL2205145) Show SMILES Cc1c(C2=NN(Cc3ccccc3)C(=O)C3CCCCC23)c2cc(F)ccc2n1CC(O)=O |t:3| Show InChI InChI=1S/C26H26FN3O3/c1-16-24(21-13-18(27)11-12-22(21)29(16)15-23(31)32)25-19-9-5-6-10-20(19)26(33)30(28-25)14-17-7-3-2-4-8-17/h2-4,7-8,11-13,19-20H,5-6,9-10,14-15H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	109	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401140 (CHEMBL2205159) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2ccccc2n1CC(O)=O Show InChI InChI=1S/C22H19N3O3/c1-15-22(17-9-5-6-10-19(17)24(15)14-21(27)28)18-11-12-20(26)25(23-18)13-16-7-3-2-4-8-16/h2-12H,13-14H2,1H3,(H,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	134	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401135 (CHEMBL2204485) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(ccc2n1CC(O)=O)S(C)(=O)=O Show InChI InChI=1S/C23H21N3O5S/c1-15-23(19-9-11-21(27)26(24-19)13-16-6-4-3-5-7-16)18-12-17(32(2,30)31)8-10-20(18)25(15)14-22(28)29/h3-12H,13-14H2,1-2H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	135	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401129 (CHEMBL2204490) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)cc(Cl)c2n1CC(O)=O Show InChI InChI=1S/C22H17ClFN3O3/c1-13-21(16-9-15(24)10-17(23)22(16)26(13)12-20(29)30)18-7-8-19(28)27(25-18)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	245	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401127 (CHEMBL2204492) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(cc(F)c2n1CC(O)=O)S(C)(=O)=O Show InChI InChI=1S/C23H20FN3O5S/c1-14-22(19-8-9-20(28)27(25-19)12-15-6-4-3-5-7-15)17-10-16(33(2,31)32)11-18(24)23(17)26(14)13-21(29)30/h3-11H,12-13H2,1-2H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	934	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401105 (CHEMBL2205151) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CC(N)=O |(7.37,-22.45,;5.83,-22.45,;4.92,-21.19,;5.69,-19.87,;7.23,-19.88,;8.01,-18.55,;9.55,-18.55,;10.31,-19.89,;9.53,-21.21,;10.29,-22.55,;11.83,-22.56,;12.61,-21.22,;11.84,-19.89,;7.24,-17.21,;8.02,-15.88,;5.7,-17.21,;4.93,-15.87,;3.38,-15.87,;2.61,-17.22,;3.39,-18.55,;4.93,-18.55,;3.45,-21.67,;2.11,-20.91,;.78,-21.68,;.78,-23.22,;2.11,-23.99,;3.45,-23.22,;4.92,-23.7,;5.4,-25.17,;4.37,-26.31,;2.86,-25.99,;4.84,-27.78,)| Show InChI InChI=1S/C26H22N4O2/c1-17-24(21-13-7-8-14-22(21)29(17)16-23(27)31)25-19-11-5-6-12-20(19)26(32)30(28-25)15-18-9-3-2-4-10-18/h2-14H,15-16H2,1H3,(H2,27,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401098 (CHEMBL2205158) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CCC(O)=O |(22.19,-53.06,;20.65,-53.06,;19.74,-51.8,;20.51,-50.48,;22.05,-50.48,;22.83,-49.16,;24.37,-49.16,;25.13,-50.5,;24.35,-51.82,;25.11,-53.16,;26.65,-53.16,;27.43,-51.82,;26.66,-50.49,;22.06,-47.82,;22.84,-46.49,;20.52,-47.81,;19.75,-46.48,;18.2,-46.48,;17.43,-47.83,;18.2,-49.16,;19.74,-49.15,;18.26,-52.28,;16.93,-51.52,;15.6,-52.29,;15.59,-53.83,;16.93,-54.6,;18.26,-53.83,;19.74,-54.31,;20.21,-55.78,;19.18,-56.92,;17.68,-56.6,;17.19,-55.14,;16.64,-57.75,)| Show InChI InChI=1S/C27H23N3O3/c1-18-25(22-13-7-8-14-23(22)29(18)16-15-24(31)32)26-20-11-5-6-12-21(20)27(33)30(28-26)17-19-9-3-2-4-10-19/h2-14H,15-17H2,1H3,(H,31,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401101 (CHEMBL2205155) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1-c1nnn[nH]1 |(26.03,-37.21,;24.5,-37.21,;23.58,-35.96,;24.36,-34.63,;25.9,-34.64,;26.67,-33.31,;28.21,-33.32,;28.98,-34.65,;28.19,-35.97,;28.96,-37.31,;30.5,-37.32,;31.27,-35.98,;30.51,-34.65,;25.91,-31.97,;26.68,-30.64,;24.37,-31.97,;23.59,-30.63,;22.05,-30.63,;21.28,-31.98,;22.05,-33.31,;23.59,-33.31,;22.11,-36.44,;20.77,-35.67,;19.45,-36.44,;19.44,-37.99,;20.78,-38.76,;22.11,-37.99,;23.58,-38.46,;24.06,-39.93,;25.53,-40.4,;25.53,-41.94,;24.07,-42.42,;23.16,-41.17,)| Show InChI InChI=1S/C25H19N7O/c1-16-22(20-13-7-8-14-21(20)32(16)25-26-29-30-27-25)23-18-11-5-6-12-19(18)24(33)31(28-23)15-17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H,26,27,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401103 (CHEMBL2205153) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CC(=O)N1CCCC1 |(37.67,-22.1,;36.13,-22.1,;35.22,-20.85,;35.99,-19.52,;37.53,-19.53,;38.31,-18.21,;39.85,-18.21,;40.61,-19.55,;39.83,-20.87,;40.59,-22.2,;42.13,-22.21,;42.91,-20.87,;42.14,-19.54,;37.54,-16.87,;38.32,-15.54,;36,-16.86,;35.23,-15.53,;33.68,-15.53,;32.91,-16.88,;33.69,-18.21,;35.23,-18.2,;33.75,-21.33,;32.41,-20.57,;31.09,-21.34,;31.08,-22.88,;32.42,-23.65,;33.75,-22.88,;35.22,-23.36,;35.7,-24.82,;34.67,-25.96,;35.14,-27.43,;33.16,-25.65,;32.53,-24.25,;31,-24.42,;30.69,-25.92,;32.02,-26.69,)| Show InChI InChI=1S/C30H28N4O2/c1-21-28(25-15-7-8-16-26(25)33(21)20-27(35)32-17-9-10-18-32)29-23-13-5-6-14-24(23)30(36)34(31-29)19-22-11-3-2-4-12-22/h2-8,11-16H,9-10,17-20H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401104 (CHEMBL2205152) Show SMILES CN(C)C(=O)Cn1c(C)c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc12 |(15.98,-25.02,;16.46,-26.48,;15.43,-27.63,;17.97,-26.8,;18.44,-28.27,;19,-25.65,;18.52,-24.19,;19.43,-22.93,;20.97,-22.93,;18.52,-21.68,;19.29,-20.35,;20.83,-20.36,;21.61,-19.03,;23.15,-19.04,;23.91,-20.38,;23.13,-21.7,;23.89,-23.03,;25.43,-23.04,;26.21,-21.7,;25.44,-20.37,;20.84,-17.7,;21.62,-16.37,;19.3,-17.69,;18.53,-16.35,;16.98,-16.36,;16.21,-17.71,;16.99,-19.04,;18.53,-19.03,;17.04,-22.16,;15.71,-21.4,;14.38,-22.17,;14.38,-23.71,;15.71,-24.48,;17.04,-23.71,)| Show InChI InChI=1S/C28H26N4O2/c1-19-26(23-15-9-10-16-24(23)31(19)18-25(33)30(2)3)27-21-13-7-8-14-22(21)28(34)32(29-27)17-20-11-5-4-6-12-20/h4-16H,17-18H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401128 (CHEMBL2204491) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(F)cc(c2n1CC(O)=O)S(C)(=O)=O Show InChI InChI=1S/C23H20FN3O5S/c1-14-22(18-8-9-20(28)27(25-18)12-15-6-4-3-5-7-15)17-10-16(24)11-19(33(2,31)32)23(17)26(14)13-21(29)30/h3-11H,12-13H2,1-2H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401102 (CHEMBL2205154) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CC(=O)NS(C)(=O)=O |(10,-36.32,;8.46,-36.32,;7.55,-35.06,;8.32,-33.74,;9.87,-33.75,;10.64,-32.42,;12.18,-32.42,;12.94,-33.76,;12.16,-35.08,;12.93,-36.42,;14.47,-36.43,;15.24,-35.09,;14.48,-33.76,;9.88,-31.08,;10.65,-29.75,;8.33,-31.07,;7.56,-29.74,;6.01,-29.74,;5.24,-31.09,;6.02,-32.42,;7.56,-32.41,;6.08,-35.54,;4.74,-34.78,;3.41,-35.55,;3.41,-37.09,;4.74,-37.86,;6.08,-37.09,;7.55,-37.57,;8.03,-39.04,;7,-40.18,;7.47,-41.65,;5.49,-39.87,;4.46,-41.01,;2.95,-40.7,;5.79,-41.78,;4.45,-42.55,)| Show InChI InChI=1S/C27H24N4O4S/c1-18-25(22-14-8-9-15-23(22)30(18)17-24(32)29-36(2,34)35)26-20-12-6-7-13-21(20)27(33)31(28-26)16-19-10-4-3-5-11-19/h3-15H,16-17H2,1-2H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401099 (CHEMBL2205157) Show SMILES CC(C(O)=O)n1c(C)c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc12 |(8.1,-55.32,;6.59,-55,;5.56,-56.14,;4.05,-55.83,;6.04,-57.61,;6.11,-53.53,;7.02,-52.28,;8.56,-52.28,;6.11,-51.02,;6.89,-49.7,;8.43,-49.71,;9.2,-48.38,;10.74,-48.38,;11.51,-49.72,;10.73,-51.04,;11.49,-52.38,;13.03,-52.39,;13.81,-51.05,;13.04,-49.72,;8.44,-47.04,;9.21,-45.71,;6.9,-47.03,;6.12,-45.7,;4.57,-45.7,;3.8,-47.05,;4.58,-48.38,;6.12,-48.37,;4.64,-51.5,;3.3,-50.74,;1.97,-51.51,;1.97,-53.05,;3.3,-53.82,;4.64,-53.05,)| Show InChI InChI=1S/C27H23N3O3/c1-17-24(22-14-8-9-15-23(22)30(17)18(2)27(32)33)25-20-12-6-7-13-21(20)26(31)29(28-25)16-19-10-4-3-5-11-19/h3-15,18H,16H2,1-2H3,(H,32,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401100 (CHEMBL2205156) Show SMILES Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CCO |(39.21,-35.7,;37.67,-35.7,;36.75,-34.45,;37.53,-33.12,;39.07,-33.13,;39.84,-31.8,;41.38,-31.81,;42.15,-33.15,;41.37,-34.47,;42.13,-35.8,;43.67,-35.81,;44.44,-34.47,;43.68,-33.14,;39.08,-30.47,;39.85,-29.14,;37.54,-30.46,;36.76,-29.13,;35.22,-29.13,;34.45,-30.48,;35.22,-31.81,;36.76,-31.8,;35.28,-34.93,;33.94,-34.17,;32.62,-34.94,;32.61,-36.48,;33.95,-37.25,;35.28,-36.48,;36.75,-36.96,;37.23,-38.42,;36.2,-39.57,;34.69,-39.25,)| Show InChI InChI=1S/C26H23N3O2/c1-18-24(22-13-7-8-14-23(22)28(18)15-16-30)25-20-11-5-6-12-21(20)26(31)29(27-25)17-19-9-3-2-4-10-19/h2-14,30H,15-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401131 (CHEMBL2204488) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cc(Cl)cc(Cl)c2n1CC(O)=O Show InChI InChI=1S/C22H17Cl2N3O3/c1-13-21(16-9-15(23)10-17(24)22(16)26(13)12-20(29)30)18-7-8-19(28)27(25-18)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Prostaglandin D2 receptor 2 (Homo sapiens (Human))	BDBM50401133 (CHEMBL2204486) Show SMILES Cc1c(-c2ccc(=O)n(Cc3ccccc3)n2)c2cccc(Br)c2n1CC(O)=O Show InChI InChI=1S/C22H18BrN3O3/c1-14-21(16-8-5-9-17(23)22(16)25(14)13-20(28)29)18-10-11-19(27)26(24-18)12-15-6-3-2-4-7-15/h2-11H,12-13H2,1H3,(H,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]PGD2 from recombinant human CRTH2 receptor expressed in CHO-K1 cells after 30 min by FRET method				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Cytochrome P450 2A6 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of CYP2A6				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of CYP3A4				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM50401097 (CHEMBL2204469) Show SMILES Cc1c(Cc2ccc(=O)n(Cc3ccc(F)cc3F)n2)c2cc(F)ccc2n1CC(O)=O Show InChI InChI=1S/C23H18F3N3O3/c1-13-18(19-8-15(24)4-6-21(19)28(13)12-23(31)32)10-17-5-7-22(30)29(27-17)11-14-2-3-16(25)9-20(14)26/h2-9H,10-12H2,1H3,(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of CYP1A2				J Med Chem 55: 5088-109 (2012) Article DOI: 10.1021/jm300007n BindingDB Entry DOI: 10.7270/Q2S75HH0
					More data for this Ligand-Target Pair

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