Compile Data Set for Download or QSAR

Found 105 hits with Last Name = 'takemoto' and Initial = 't'   

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
Sphingomyelinase C (Bacillus cereus)	BDBM248063 (SMY-540) Show SMILES CCCCCC(=O)N[C@@H](COCc1cccc(n1)-c1ccccn1)[C@H](O)c1ccccc1 |r| Show InChI InChI=1S/C26H31N3O3/c1-2-3-5-16-25(30)29-24(26(31)20-11-6-4-7-12-20)19-32-18-21-13-10-15-23(28-21)22-14-8-9-17-27-22/h4,6-15,17,24,26,31H,2-3,5,16,18-19H2,1H3,(H,29,30)/t24-,26+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.30E+3	-34.9	800	n/a	n/a	n/a	n/a	7.5	37
Tokushima Bunri University					Assay Description Briefly, Bc-SMase (50 ng/ml) was treated at 37 °C for 60 min with various compounds that were solubilized in dimethylacetoamide. The reaction mix...				J Enzyme Inhib Med Chem 29: 303-10 (2014) Article DOI: 10.3109/14756366.2013.777717 BindingDB Entry DOI: 10.7270/Q2NV9H50
					More data for this Ligand-Target Pair
Sphingomyelinase C (Bacillus cereus)	BDBM248061 (SMY-471) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COCc1cccc(n1)-c1ccccn1 |r| Show InChI InChI=1S/C29H45N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-29(33)26(30)24-34-23-25-18-17-20-28(32-25)27-19-15-16-22-31-27/h14-22,26,29,33H,2-13,23-24,30H2,1H3/b21-14+/t26-,29+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.80E+3	-33.0	900	n/a	n/a	n/a	n/a	7.5	37
Tokushima Bunri University					Assay Description Briefly, Bc-SMase (50 ng/ml) was treated at 37 °C for 60 min with various compounds that were solubilized in dimethylacetoamide. The reaction mix...				J Enzyme Inhib Med Chem 29: 303-10 (2014) Article DOI: 10.3109/14756366.2013.777717 BindingDB Entry DOI: 10.7270/Q2NV9H50
					More data for this Ligand-Target Pair
Sphingomyelinase C (Bacillus cereus)	BDBM248057 (RY221B-a) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COCc1cccc(n1)-c1ccccn1)NC(=O)CCCCC |r| Show InChI InChI=1S/C35H55N3O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-25-34(39)33(38-35(40)26-17-6-4-2)29-41-28-30-22-21-24-32(37-30)31-23-19-20-27-36-31/h18-25,27,33-34,39H,3-17,26,28-29H2,1-2H3,(H,38,40)/b25-18+/t33-,34+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.20E+3	-31.4	1.20E+3	n/a	n/a	n/a	n/a	7.5	37
Tokushima Bunri University					Assay Description Briefly, Bc-SMase (50 ng/ml) was treated at 37 °C for 60 min with various compounds that were solubilized in dimethylacetoamide. The reaction mix...				J Enzyme Inhib Med Chem 29: 303-10 (2014) Article DOI: 10.3109/14756366.2013.777717 BindingDB Entry DOI: 10.7270/Q2NV9H50
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50403793 (CHEMBL2115415) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.720	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310094 ((7-carbamoyl-8H-indeno[1,2-d]thiazol-4-yloxy)methy...) Show SMILES NC(=O)c1ccc(OCP(O)(O)=O)c-2c1Cc1scnc-21 Show InChI InChI=1S/C12H11N2O5PS/c13-12(15)6-1-2-8(19-5-20(16,17)18)10-7(6)3-9-11(10)14-4-21-9/h1-2,4H,3,5H2,(H2,13,15)(H2,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310095 ((7-(methylcarbamoyl)-8H-indeno[1,2-d]thiazol-4-ylo...) Show SMILES CNC(=O)c1ccc(OCP(O)(O)=O)c-2c1Cc1scnc-21 Show InChI InChI=1S/C13H13N2O5PS/c1-14-13(16)7-2-3-9(20-6-21(17,18)19)11-8(7)4-10-12(11)15-5-22-10/h2-3,5H,4,6H2,1H3,(H,14,16)(H2,17,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50090485 (CHEMBL295615 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310093 ((7-(pyrimidin-5-yl)-8H-indeno[1,2-d]thiazol-4-ylox...) Show SMILES OP(O)(=O)COc1ccc(c2Cc3scnc3-c12)-c1cncnc1 Show InChI InChI=1S/C15H12N3O4PS/c19-23(20,21)8-22-12-2-1-10(9-4-16-6-17-5-9)11-3-13-15(14(11)12)18-7-24-13/h1-2,4-7H,3,8H2,(H2,19,20,21)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50403793 (CHEMBL2115415) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50090485 (CHEMBL295615 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.80	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310086 ((7-chloro-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES OP(O)(=O)COc1ccc(Cl)c2Cc3scnc3-c12 Show InChI InChI=1S/C11H9ClNO4PS/c12-7-1-2-8(17-5-18(14,15)16)10-6(7)3-9-11(10)13-4-19-9/h1-2,4H,3,5H2,(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310083 ((7-methyl-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES Cc1ccc(OCP(O)(O)=O)c-2c1Cc1scnc-21 Show InChI InChI=1S/C12H12NO4PS/c1-7-2-3-9(17-6-18(14,15)16)11-8(7)4-10-12(11)13-5-19-10/h2-3,5H,4,6H2,1H3,(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310088 ((6,7-difluoro-8H-indeno[1,2-d]thiazol-4-yloxy)meth...) Show SMILES OP(O)(=O)COc1cc(F)c(F)c2Cc3scnc3-c12 Show InChI InChI=1S/C11H8F2NO4PS/c12-6-2-7(18-4-19(15,16)17)9-5(10(6)13)1-8-11(9)14-3-20-8/h2-3H,1,4H2,(H2,15,16,17)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310092 ((7-(pyridin-4-yl)-8H-indeno[1,2-d]thiazol-4-yloxy)...) Show SMILES OP(O)(=O)COc1ccc(c2Cc3scnc3-c12)-c1ccncc1 Show InChI InChI=1S/C16H13N2O4PS/c19-23(20,21)9-22-13-2-1-11(10-3-5-17-6-4-10)12-7-14-16(15(12)13)18-8-24-14/h1-6,8H,7,9H2,(H2,19,20,21)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310091 ((7-(pyridin-3-yl)-8H-indeno[1,2-d]thiazol-4-yloxy)...) Show SMILES OP(O)(=O)COc1ccc(c2Cc3scnc3-c12)-c1cccnc1 Show InChI InChI=1S/C16H13N2O4PS/c19-23(20,21)9-22-13-4-3-11(10-2-1-5-17-7-10)12-6-14-16(15(12)13)18-8-24-14/h1-5,7-8H,6,9H2,(H2,19,20,21)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50293594 (5-(2-amino-5-isobutylthiazol-4-yl)furan-2-ylphosph...) Show SMILES CC(C)Cc1sc(N)nc1-c1ccc(o1)P(O)(O)=O Show InChI InChI=1S/C11H15N2O4PS/c1-6(2)5-8-10(13-11(12)19-8)7-3-4-9(17-7)18(14,15)16/h3-4,6H,5H2,1-2H3,(H2,12,13)(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50293594 (5-(2-amino-5-isobutylthiazol-4-yl)furan-2-ylphosph...) Show SMILES CC(C)Cc1sc(N)nc1-c1ccc(o1)P(O)(O)=O Show InChI InChI=1S/C11H15N2O4PS/c1-6(2)5-8-10(13-11(12)19-8)7-3-4-9(17-7)18(14,15)16/h3-4,6H,5H2,1-2H3,(H2,12,13)(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310087 ((6,7-dimethyl-8H-indeno[1,2-d]thiazol-4-yloxy)meth...) Show SMILES Cc1cc(OCP(O)(O)=O)c-2c(Cc3scnc-23)c1C Show InChI InChI=1S/C13H14NO4PS/c1-7-3-10(18-6-19(15,16)17)12-9(8(7)2)4-11-13(12)14-5-20-11/h3,5H,4,6H2,1-2H3,(H2,15,16,17)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50403790 (CHEMBL2114963) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310084 ((7-ethyl-8H-indeno[1,2-d]thiazol-4-yloxy)methylpho...) Show SMILES CCc1ccc(OCP(O)(O)=O)c-2c1Cc1scnc-21 Show InChI InChI=1S/C13H14NO4PS/c1-2-8-3-4-10(18-7-19(15,16)17)12-9(8)5-11-13(12)14-6-20-11/h3-4,6H,2,5,7H2,1H3,(H2,15,16,17)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310082 ((8H-indeno[1,2-d]thiazol-4-yloxy)methylphosphonic ...) Show SMILES OP(O)(=O)COc1cccc2Cc3scnc3-c12 Show InChI InChI=1S/C11H10NO4PS/c13-17(14,15)6-16-8-3-1-2-7-4-9-11(10(7)8)12-5-18-9/h1-3,5H,4,6H2,(H2,13,14,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302495 (2-amino-4,5-dihydronaphtho[1,2-d][1,3]thiazol-8-yl...) Show SMILES Nc1nc-2c(CCc3ccc(OP(O)(O)=O)cc-23)s1 Show InChI InChI=1S/C11H11N2O4PS/c12-11-13-10-8-5-7(17-18(14,15)16)3-1-6(8)2-4-9(10)19-11/h1,3,5H,2,4H2,(H2,12,13)(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310085 ((7-fluoro-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES OP(O)(=O)COc1ccc(F)c2Cc3scnc3-c12 Show InChI InChI=1S/C11H9FNO4PS/c12-7-1-2-8(17-5-18(14,15)16)10-6(7)3-9-11(10)13-4-19-9/h1-2,4H,3,5H2,(H2,14,15,16)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50090487 (CHEMBL298247 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50403793 (CHEMBL2115415) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302497 (CHEMBL572208 | Phosphoric acid mono-2-amino-5,6-di...) Show SMILES Nc1nc-2c(CCCc3ccc(OP(O)(O)=O)cc-23)s1 Show InChI InChI=1S/C12H13N2O4PS/c13-12-14-11-9-6-8(18-19(15,16)17)5-4-7(9)2-1-3-10(11)20-12/h4-6H,1-3H2,(H2,13,14)(H2,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310089 ((7-phenyl-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES OP(O)(=O)COc1ccc(c2Cc3scnc3-c12)-c1ccccc1 Show InChI InChI=1S/C17H14NO4PS/c19-23(20,21)10-22-14-7-6-12(11-4-2-1-3-5-11)13-8-15-17(16(13)14)18-9-24-15/h1-7,9H,8,10H2,(H2,19,20,21)	PDB UniProtKB/SwissProt 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
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310090 ((7-(pyridin-2-yl)-8H-indeno[1,2-d]thiazol-4-yloxy)...) Show SMILES OP(O)(=O)COc1ccc(c2Cc3scnc3-c12)-c1ccccn1 Show InChI InChI=1S/C16H13N2O4PS/c19-23(20,21)9-22-13-5-4-10(12-3-1-2-6-17-12)11-7-14-16(15(11)13)18-8-24-14/h1-6,8H,7,9H2,(H2,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50090485 (CHEMBL295615 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50090487 (CHEMBL298247 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302506 ((2-amino-4,5-dihydronaphtho[1,2-d]thiazol-8-yl)dif...) Show SMILES Nc1nc-2c(CCc3ccc(cc-23)C(F)(F)P(O)(O)=O)s1 Show InChI InChI=1S/C12H11F2N2O3PS/c13-12(14,20(17,18)19)7-3-1-6-2-4-9-10(8(6)5-7)16-11(15)21-9/h1,3,5H,2,4H2,(H2,15,16)(H2,17,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50403790 (CHEMBL2114963) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302493 (2-amino-8H-indeno[1,2-d]thiazol-4-yl dihydrogen ph...) Show SMILES Nc1nc-2c(Cc3cccc(OP(O)(O)=O)c-23)s1 Show InChI InChI=1S/C10H9N2O4PS/c11-10-12-9-7(18-10)4-5-2-1-3-6(8(5)9)16-17(13,14)15/h1-3H,4H2,(H2,11,12)(H2,13,14,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302500 ((2-amino-8H-indeno[1,2-d]thiazol-4-yloxy)methylpho...) Show SMILES Nc1nc-2c(Cc3cccc(OCP(O)(O)=O)c-23)s1 Show InChI InChI=1S/C11H11N2O4PS/c12-11-13-10-8(19-11)4-6-2-1-3-7(9(6)10)17-5-18(14,15)16/h1-3H,4-5H2,(H2,12,13)(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302500 ((2-amino-8H-indeno[1,2-d]thiazol-4-yloxy)methylpho...) Show SMILES Nc1nc-2c(Cc3cccc(OCP(O)(O)=O)c-23)s1 Show InChI InChI=1S/C11H11N2O4PS/c12-11-13-10-8(19-11)4-6-2-1-3-7(9(6)10)17-5-18(14,15)16/h1-3H,4-5H2,(H2,12,13)(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302490 ((2-Amino-5,6-dihydro-4H-3-thia-1-aza-benzo[e]azule...) Show SMILES Nc1nc-2c(CCCc3ccc(cc-23)P(O)(O)=O)s1 Show InChI InChI=1S/C12H13N2O3PS/c13-12-14-11-9-6-8(18(15,16)17)5-4-7(9)2-1-3-10(11)19-12/h4-6H,1-3H2,(H2,13,14)(H2,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	169	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50403790 (CHEMBL2114963) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)c2ccccc2C[S@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50090487 (CHEMBL298247 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50403791 (CHEMBL2114965) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)c2ccccc2C[S@@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50403792 (CHEMBL2115416) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)c2ccccc2C[S@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310081 ((2-bromo-8H-indeno[1,2-d]thiazol-4-yloxy)methylpho...) Show SMILES OP(O)(=O)COc1cccc2Cc3sc(Br)nc3-c12 Show InChI InChI=1S/C11H9BrNO4PS/c12-11-13-10-8(19-11)4-6-2-1-3-7(9(6)10)17-5-18(14,15)16/h1-3H,4-5H2,(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	772	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50302505 ((2-amino-4,5-dihydronaphtho[1,2-d]thiazol-8-yl)met...) Show SMILES Nc1nc-2c(CCc3ccc(CP(O)(O)=O)cc-23)s1 Show InChI InChI=1S/C12H13N2O3PS/c13-12-14-11-9-5-7(6-18(15,16)17)1-2-8(9)3-4-10(11)19-12/h1-2,5H,3-4,6H2,(H2,13,14)(H2,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human liver FBPase				Bioorg Med Chem Lett 19: 5909-12 (2009) Article DOI: 10.1016/j.bmcl.2009.08.081 BindingDB Entry DOI: 10.7270/Q23J3D22
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310080 ((2-chloro-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES OP(O)(=O)COc1cccc2Cc3sc(Cl)nc3-c12 Show InChI InChI=1S/C11H9ClNO4PS/c12-11-13-10-8(19-11)4-6-2-1-3-7(9(6)10)17-5-18(14,15)16/h1-3H,4-5H2,(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	908	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50310079 ((2-methyl-8H-indeno[1,2-d]thiazol-4-yloxy)methylph...) Show SMILES Cc1nc-2c(Cc3cccc(OCP(O)(O)=O)c-23)s1 Show InChI InChI=1S/C12H12NO4PS/c1-7-13-12-10(19-7)5-8-3-2-4-9(11(8)12)17-6-18(14,15)16/h2-4H,5-6H2,1H3,(H2,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	995	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Sankyo Co, Ltd Curated by ChEMBL					Assay Description Inhibition of human liver recombinant FBPase				Bioorg Med Chem Lett 20: 1004-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.056 BindingDB Entry DOI: 10.7270/Q2JW8F1D
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50090484 (CHEMBL46795 | spiro[(2-hydroxy)indane-1,40-piperid...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Neuromedin-K receptor (GUINEA PIG)	BDBM50090484 (CHEMBL46795 | spiro[(2-hydroxy)indane-1,40-piperid...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 3 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50090484 (CHEMBL46795 | spiro[(2-hydroxy)indane-1,40-piperid...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)[C@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-P receptor (GUINEA PIG)	BDBM50090482 (CHEMBL295785 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)[C@@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 1 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50403791 (CHEMBL2114965) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)c2ccccc2C[S@@]3=O)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair
Substance-K receptor (GUINEA PIG)	BDBM50090482 (CHEMBL295785 | spiro[(2-hydroxy)indane-1,40-piperi...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N1CCO[C@](CCN2CCC3(CC2)[C@@H](O)Cc2ccccc32)(C1)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C35H40Cl2N2O6/c1-42-29-18-24(19-30(43-2)32(29)44-3)33(41)39-16-17-45-35(22-39,25-8-9-27(36)28(37)21-25)12-15-38-13-10-34(11-14-38)26-7-5-4-6-23(26)20-31(34)40/h4-9,18-19,21,31,40H,10-17,20,22H2,1-3H3/t31-,35+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description The compound was evaluated in vitro for its ability to displace [3H]-SP from Tachykinin receptor 2 of male guinea pig lung membrane				Bioorg Med Chem Lett 10: 1665-8 (2000) BindingDB Entry DOI: 10.7270/Q2QZ297D
					More data for this Ligand-Target Pair

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