Compile Data Set for Download or QSAR

Found 160 hits with Last Name = 'murakami' 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
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50335557 (CHEMBL1652605 | N,N-dipropyl-N'-[4-({[(1H-imidazol...) Show SMILES CCCN(CCC)CCCCN(C)Cc1ccc(CN(Cc2ncc[nH]2)Cc2nccn2C)cc1 Show InChI InChI=1S/C28H45N7/c1-5-16-34(17-6-2)19-8-7-18-32(3)21-25-9-11-26(12-10-25)22-35(23-27-29-13-14-30-27)24-28-31-15-20-33(28)4/h9-15,20H,5-8,16-19,21-24H2,1-4H3,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.610	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Infectious Diseases Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha form CXCR4 expressed in CHO cells by scintillation counting				Antimicrob Agents Chemother 53: 2940-8 (2009) Article DOI: 10.1128/AAC.01727-08 BindingDB Entry DOI: 10.7270/Q2GF0TR7
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517802 (CHEMBL4457992) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccc2c(CN3CCCNCCNCCCNCC3)cccc2c1 Show InChI InChI=1S/C34H45N7/c1-3-17-38-32(10-1)27-41(28-33-11-2-4-18-39-33)25-29-12-13-34-30(24-29)8-5-9-31(34)26-40-22-7-16-36-20-19-35-14-6-15-37-21-23-40/h1-5,8-13,17-18,24,35-37H,6-7,14-16,19-23,25-28H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50335557 (CHEMBL1652605 | N,N-dipropyl-N'-[4-({[(1H-imidazol...) Show SMILES CCCN(CCC)CCCCN(C)Cc1ccc(CN(Cc2ncc[nH]2)Cc2nccn2C)cc1 Show InChI InChI=1S/C28H45N7/c1-5-16-34(17-6-2)19-8-7-18-32(3)21-25-9-11-26(12-10-25)22-35(23-27-29-13-14-30-27)24-28-31-15-20-33(28)4/h9-15,20H,5-8,16-19,21-24H2,1-4H3,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Infectious Diseases Curated by ChEMBL					Assay Description Inhibition of Mab 12G5 binding to wild type CXCR4 expressed in HEK293 cells				Antimicrob Agents Chemother 53: 2940-8 (2009) Article DOI: 10.1128/AAC.01727-08 BindingDB Entry DOI: 10.7270/Q2GF0TR7
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517800 (CHEMBL4451705) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccnc(c1)-c1cccc(CN2CCCNCCNCCCNCC2)c1 Show InChI InChI=1S/C35H46N8/c1-3-16-39-33(10-1)28-43(29-34-11-2-4-17-40-34)27-31-12-18-41-35(25-31)32-9-5-8-30(24-32)26-42-22-7-15-37-20-19-36-13-6-14-38-21-23-42/h1-5,8-12,16-18,24-25,36-38H,6-7,13-15,19-23,26-29H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381555 (CHEMBL2018097) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2cc3ccccc3s2)c1 |r| Show InChI InChI=1S/C21H21ClO5S/c22-15-6-5-12(21-20(26)19(25)18(24)16(10-23)27-21)7-13(15)9-14-8-11-3-1-2-4-17(11)28-14/h1-8,16,18-21,23-26H,9-10H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517803 (CHEMBL4529751) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccc(cc1)-c1ncccc1CN1CCCNCCNCCCNCC1 Show InChI InChI=1S/C35H46N8/c1-3-18-39-33(9-1)28-43(29-34-10-2-4-19-40-34)26-30-11-13-31(14-12-30)35-32(8-5-20-41-35)27-42-24-7-17-37-22-21-36-15-6-16-38-23-25-42/h1-5,8-14,18-20,36-38H,6-7,15-17,21-29H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517804 (CHEMBL4548792) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccc(cc1)-c1ccccc1CN1CCCNCCNCCCNCC1 Show InChI InChI=1S/C36H47N7/c1-2-12-36(33(9-1)28-42-25-8-19-38-23-22-37-17-7-18-39-24-26-42)32-15-13-31(14-16-32)27-43(29-34-10-3-5-20-40-34)30-35-11-4-6-21-41-35/h1-6,9-16,20-21,37-39H,7-8,17-19,22-30H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.70	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381554 (CHEMBL2018096) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(F)c(Cc2cc3ccccc3s2)c1 |r| Show InChI InChI=1S/C21H21FO5S/c22-15-6-5-12(21-20(26)19(25)18(24)16(10-23)27-21)7-13(15)9-14-8-11-3-1-2-4-17(11)28-14/h1-8,16,18-21,23-26H,9-10H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.40	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517798 (CHEMBL4568686) Show SMILES C(N(Cc1ccccn1)Cc1ccccc1-c1cccc(CN2CCCNCCNCCCNCC2)c1)c1ccccn1 Show InChI InChI=1S/C36H47N7/c1-2-15-36(33(11-1)28-43(29-34-13-3-5-19-40-34)30-35-14-4-6-20-41-35)32-12-7-10-31(26-32)27-42-24-9-18-38-22-21-37-16-8-17-39-23-25-42/h1-7,10-15,19-20,26,37-39H,8-9,16-18,21-25,27-30H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436116 (CHEMBL2397452) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2cc3cccccc3c2)c1 |r| Show InChI InChI=1S/C23H23ClO5/c24-18-7-6-16(23-22(28)21(27)20(26)19(12-25)29-23)11-17(18)10-13-8-14-4-2-1-3-5-15(14)9-13/h1-9,11,19-23,25-28H,10,12H2/t19-,20-,21+,22-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436115 (CHEMBL2397450) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3cccccc3c2)ccc1O |r| Show InChI InChI=1S/C23H24O6/c24-12-19-20(26)21(27)22(28)23(29-19)17-11-13(6-7-18(17)25)8-14-9-15-4-2-1-3-5-16(15)10-14/h1-7,9-11,19-28H,8,12H2/t19-,20-,21+,22-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381548 (CHEMBL2018090) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3ccccc3s2)ccc1O |r| Show InChI InChI=1S/C21H22O6S/c22-10-16-18(24)19(25)20(26)21(27-16)14-8-11(5-6-15(14)23)7-13-9-12-3-1-2-4-17(12)28-13/h1-6,8-9,16,18-26H,7,10H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.80	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381537 (CHEMBL2017954) Show SMILES CCc1ccc(Cc2cccc(c2)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C21H26O5/c1-2-13-6-8-14(9-7-13)10-15-4-3-5-16(11-15)21-20(25)19(24)18(23)17(12-22)26-21/h3-9,11,17-25H,2,10,12H2,1H3/t17-,18-,19+,20-,21+/m1/s1	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
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517799 (CHEMBL4531581) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccc2cc(CN3CCCNCCNCCCNCC3)ccc2c1 Show InChI InChI=1S/C34H45N7/c1-3-16-38-33(7-1)27-41(28-34-8-2-4-17-39-34)26-30-10-12-31-23-29(9-11-32(31)24-30)25-40-21-6-15-36-19-18-35-13-5-14-37-20-22-40/h1-4,7-12,16-17,23-24,35-37H,5-6,13-15,18-22,25-28H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381549 (CHEMBL2018091) Show SMILES COc1ccc(Cc2cc3ccccc3s2)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C22H24O6S/c1-27-16-7-6-12(8-14-10-13-4-2-3-5-18(13)29-14)9-15(16)22-21(26)20(25)19(24)17(11-23)28-22/h2-7,9-10,17,19-26H,8,11H2,1H3/t17-,19-,20+,21-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436114 (CHEMBL2397451) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(F)c(Cc2cc3cccccc3c2)c1 |r| Show InChI InChI=1S/C23H23FO5/c24-18-7-6-16(23-22(28)21(27)20(26)19(12-25)29-23)11-17(18)10-13-8-14-4-2-1-3-5-15(14)9-13/h1-9,11,19-23,25-28H,10,12H2/t19-,20-,21+,22-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381553 (CHEMBL2018095) Show SMILES COc1ccc(cc1Cc1cc2ccccc2s1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C22H24O6S/c1-27-16-7-6-13(22-21(26)20(25)19(24)17(11-23)28-22)8-14(16)10-15-9-12-4-2-3-5-18(12)29-15/h2-9,17,19-26H,10-11H2,1H3/t17-,19-,20+,21-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436113 (CHEMBL2397449) Show SMILES COc1ccc(Cc2cc3cccccc3c2)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C24H26O6/c1-29-19-8-7-14(9-15-10-16-5-3-2-4-6-17(16)11-15)12-18(19)24-23(28)22(27)21(26)20(13-25)30-24/h2-8,10-12,20-28H,9,13H2,1H3/t20-,21-,22+,23-,24+/m1/s1	PDB UniProtKB/SwissProt 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
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436112 (CHEMBL2397453) Show SMILES COc1ccc(cc1Cc1cc2cccccc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C24H26O6/c1-29-19-8-7-17(24-23(28)22(27)21(26)20(13-25)30-24)12-18(19)11-14-9-15-5-3-2-4-6-16(15)10-14/h2-10,12,20-28H,11,13H2,1H3/t20-,21-,22+,23-,24+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436111 (CHEMBL2397442) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2cc3cccccc3c2)c1 |r| Show InChI InChI=1S/C23H24O5/c24-13-19-20(25)21(26)22(27)23(28-19)18-8-4-5-14(10-18)9-15-11-16-6-2-1-3-7-17(16)12-15/h1-8,10-12,19-27H,9,13H2/t19-,20-,21+,22-,23+/m1/s1	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
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381544 (CHEMBL2018084) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2cc3ccccc3s2)c1 |r| Show InChI InChI=1S/C21H22O5S/c22-11-16-18(23)19(24)20(25)21(26-16)14-6-3-4-12(8-14)9-15-10-13-5-1-2-7-17(13)27-15/h1-8,10,16,18-25H,9,11H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50517801 (CHEMBL4532299) Show SMILES C(N(Cc1ccccn1)Cc1ccccn1)c1ccc(CN2CCCNCCNCCCNCC2)cc1 Show InChI InChI=1S/C30H43N7/c1-3-16-34-29(7-1)25-37(26-30-8-2-4-17-35-30)24-28-11-9-27(10-12-28)23-36-21-6-15-32-19-18-31-13-5-14-33-20-22-36/h1-4,7-12,16-17,31-33H,5-6,13-15,18-26H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Medical and Dental University (TMDU) Curated by ChEMBL					Assay Description Competitive inhibition of TAMRAAc-TZ14011 binding to CXCR4 (unknown origin) expressed in CHO cells in presence of ZnCl2 by NanoBRET assay relative to...				Bioorg Med Chem 27: 1130-1138 (2019) Article DOI: 10.1016/j.bmc.2019.02.013 BindingDB Entry DOI: 10.7270/Q2QR51HR
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436110 (CHEMBL2397447) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3cccccc3c2)ccc1F |r| Show InChI InChI=1S/C23H23FO5/c24-18-7-6-13(8-14-9-15-4-2-1-3-5-16(15)10-14)11-17(18)23-22(28)21(27)20(26)19(12-25)29-23/h1-7,9-11,19-23,25-28H,8,12H2/t19-,20-,21+,22-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381550 (CHEMBL2018092) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3ccccc3s2)ccc1F |r| Show InChI InChI=1S/C21H21FO5S/c22-15-6-5-11(7-13-9-12-3-1-2-4-17(12)28-13)8-14(15)21-20(26)19(25)18(24)16(10-23)27-21/h1-6,8-9,16,18-21,23-26H,7,10H2/t16-,18-,19+,20-,21+/m1/s1	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
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580671 (CHEMBL5083166) Show SMILES CC1(C)CC(=O)C2=C(C1)NC1=C(C2c2ccc(Br)cc2)C(=O)c2ccccc12 |c:6,11| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human FHIT expressed in Escherichia coli BL21(DE3)-RIL cells using AP3A as substrate pretreated for 10 mins followed by substrate addit...				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580669 (CHEMBL5079345) Show SMILES ONC(=O)COc1ccc2c3CCCCc3c(=O)oc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT assessed as reduction in AP3Aase activity measured after 45 mins by HPLC analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436109 (CHEMBL2397448) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3cccccc3c2)ccc1Cl |r| Show InChI InChI=1S/C23H23ClO5/c24-18-7-6-13(8-14-9-15-4-2-1-3-5-16(15)10-14)11-17(18)23-22(28)21(27)20(26)19(12-25)29-23/h1-7,9-11,19-23,25-28H,8,12H2/t19-,20-,21+,22-,23+/m1/s1	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
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381539 (CHEMBL2017956) Show SMILES CCc1ccc(Cc2cc(c[nH]2)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C19H25NO5/c1-2-11-3-5-12(6-4-11)7-14-8-13(9-20-14)19-18(24)17(23)16(22)15(10-21)25-19/h3-6,8-9,15-24H,2,7,10H2,1H3/t15-,16-,17+,18-,19+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Rattus norvegicus)	BDBM50049730 (2-(5-(2-methyl-3-phenylallylidene)-4-oxo-2-thioxot...) Show SMILES C\C(\C=C1/SC(=S)N(CC(O)=O)C1=O)=C/c1ccccc1 Show InChI InChI=1S/C15H13NO3S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(19)16(9-13(17)18)15(20)21-12/h2-8H,9H2,1H3,(H,17,18)/b10-7+,12-8-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of aldose reductase in rat lens homogenates by fluorophotometer				J Nat Prod 65: 1151-5 (2002) BindingDB Entry DOI: 10.7270/Q2T43SV9
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381552 (CHEMBL2018094) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(O)c(Cc2cc3ccccc3s2)c1 |r| Show InChI InChI=1S/C21H22O6S/c22-10-16-18(24)19(25)20(26)21(27-16)12-5-6-15(23)13(7-12)9-14-8-11-3-1-2-4-17(11)28-14/h1-8,16,18-26H,9-10H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381551 (CHEMBL2018093) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cc(Cc2cc3ccccc3s2)ccc1Cl |r| Show InChI InChI=1S/C21H21ClO5S/c22-15-6-5-11(7-13-9-12-3-1-2-4-17(12)28-13)8-14(15)21-20(26)19(25)18(24)16(10-23)27-21/h1-6,8-9,16,18-21,23-26H,7,10H2/t16-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	92	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436108 (CHEMBL2397441) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2ccc3cccc3cc2)c1 |r| Show InChI InChI=1S/C23H24O5/c24-13-19-20(25)21(26)22(27)23(28-19)18-6-1-3-15(12-18)11-14-7-9-16-4-2-5-17(16)10-8-14/h1-10,12,19-27H,11,13H2/t19-,20-,21+,22-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381538 (CHEMBL2017955) Show SMILES COc1ccc(Cc2cc(cs2)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C18H22O6S/c1-23-12-4-2-10(3-5-12)6-13-7-11(9-25-13)18-17(22)16(21)15(20)14(8-19)24-18/h2-5,7,9,14-22H,6,8H2,1H3/t14-,15-,16+,17-,18+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580669 (CHEMBL5079345) Show SMILES ONC(=O)COc1ccc2c3CCCCc3c(=O)oc2c1Br Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580665 (CHEMBL5078809) Show SMILES Cc1c(OCC(=O)NO)ccc2c3CCCCc3c(=O)oc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT assessed as reduction in AP3Aase activity measured after 45 mins by HPLC analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50035696 (1,1''-{1,4-phenylenebis(methylene)}-bis{1,4,8,11-t...) Show SMILES C(N1CCCNCCNCCCNCC1)c1ccc(CN2CCCNCCNCCCNCC2)cc1 Show InChI InChI=1S/C28H54N8/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36/h5-8,29-34H,1-4,9-26H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	289	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Infectious Diseases Curated by ChEMBL					Assay Description Inhibition of Mab 12G5 binding to wild type CXCR4 expressed in HEK293 cells				Antimicrob Agents Chemother 53: 2940-8 (2009) Article DOI: 10.1128/AAC.01727-08 BindingDB Entry DOI: 10.7270/Q2GF0TR7
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381540 (CHEMBL2018080) Show SMILES CCc1ccc(Cc2cccc(n2)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C20H25NO5/c1-2-12-6-8-13(9-7-12)10-14-4-3-5-15(21-14)20-19(25)18(24)17(23)16(11-22)26-20/h3-9,16-20,22-25H,2,10-11H2,1H3/t16-,17-,18+,19-,20+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381546 (CHEMBL2018087) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2nc3ccccc3s2)c1 |r| Show InChI InChI=1S/C20H21NO5S/c22-10-14-17(23)18(24)19(25)20(26-14)12-5-3-4-11(8-12)9-16-21-13-6-1-2-7-15(13)27-16/h1-8,14,17-20,22-25H,9-10H2/t14-,17-,18+,19-,20+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381545 (CHEMBL2018085) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2cc3ccccc3o2)c1 |r| Show InChI InChI=1S/C21H22O6/c22-11-17-18(23)19(24)20(25)21(27-17)14-6-3-4-12(8-14)9-15-10-13-5-1-2-7-16(13)26-15/h1-8,10,17-25H,9,11H2/t17-,18-,19+,20-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	675	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580675 (CHEMBL5075611) Show SMILES CN1C(=O)N\C(=C\c2cccn2-c2ccc(cc2)C(O)=O)C1=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50483220 (CHEMBL1535664) Show SMILES CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)c1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C18H20N2O6/c1-18(2,3)19(11-13-7-5-4-6-8-13)15(21)12-25-17(22)14-9-10-16(26-14)20(23)24/h4-10H,11-12H2,1-3H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Chiba University Curated by ChEMBL					Assay Description Inhibition RNase H activity of HIV1 reverse transcriptase expressed in Escherichia coli stain BL21(DE3)pLysS				Bioorg Med Chem 19: 816-25 (2011) Article DOI: 10.1016/j.bmc.2010.12.011 BindingDB Entry DOI: 10.7270/Q2JH3Q11
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50436120 (CHEMBL2397445) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2cc3cccccc3c2Cc2ccccc2)c1 |r| Show InChI InChI=1S/C30H30O5/c31-18-26-27(32)28(33)29(34)30(35-26)22-12-7-10-20(14-22)15-23-17-21-11-5-2-6-13-24(21)25(23)16-19-8-3-1-4-9-19/h1-14,17,26-34H,15-16,18H2/t26-,27-,28+,29-,30+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]-methyl-alpha-D-glucopyranoside accumulation				Bioorg Med Chem 21: 3934-48 (2013) Article DOI: 10.1016/j.bmc.2013.03.067 BindingDB Entry DOI: 10.7270/Q2ZC848C
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580679 (CHEMBL5093727) Show SMILES CCOC(=O)c1c(C)sc(N)c1C(=O)OCC Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580672 (CHEMBL5078205) Show SMILES OC(=O)c1ccc2[nH]c(nc2c1)-c1ccnc(c1)-c1cccnc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580665 (CHEMBL5078809) Show SMILES Cc1c(OCC(=O)NO)ccc2c3CCCCc3c(=O)oc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50483229 (CHEMBL1642815) Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)OCCc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C13H10N2O7/c16-13(11-5-6-12(22-11)15(19)20)21-8-7-9-1-3-10(4-2-9)14(17)18/h1-6H,7-8H2	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chiba University Curated by ChEMBL					Assay Description Inhibition RNase H activity of HIV1 reverse transcriptase expressed in Escherichia coli stain BL21(DE3)pLysS				Bioorg Med Chem 19: 816-25 (2011) Article DOI: 10.1016/j.bmc.2010.12.011 BindingDB Entry DOI: 10.7270/Q2JH3Q11
					More data for this Ligand-Target Pair
Sodium/glucose cotransporter 2 (Homo sapiens (Human))	BDBM50381547 (CHEMBL2018088) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1cccc(Cc2nc3ccccc3o2)c1 |r| Show InChI InChI=1S/C20H21NO6/c22-10-15-17(23)18(24)19(25)20(27-15)12-5-3-4-11(8-12)9-16-21-13-6-1-2-7-14(13)26-16/h1-8,15,17-20,22-25H,9-10H2/t15-,17-,18+,19-,20+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells assessed as [14C]AMG accumulation after 2 hrs by scintillation counting				Bioorg Med Chem 20: 3263-79 (2012) Article DOI: 10.1016/j.bmc.2012.03.051 BindingDB Entry DOI: 10.7270/Q2W66MSS
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50483244 (CHEMBL1642816) Show SMILES CN(OC(=O)c1ccc(o1)[N+]([O-])=O)C(=O)c1ccc(o1)[N+]([O-])=O Show InChI InChI=1S/C11H7N3O9/c1-12(10(15)6-2-4-8(21-6)13(17)18)23-11(16)7-3-5-9(22-7)14(19)20/h2-5H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chiba University Curated by ChEMBL					Assay Description Inhibition RNase H activity of HIV1 reverse transcriptase expressed in Escherichia coli stain BL21(DE3)pLysS				Bioorg Med Chem 19: 816-25 (2011) Article DOI: 10.1016/j.bmc.2010.12.011 BindingDB Entry DOI: 10.7270/Q2JH3Q11
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50483241 (CHEMBL1642803) Show SMILES CC(C)(C)NC(=O)COC(=O)c1ccc(s1)[N+]([O-])=O Show InChI InChI=1S/C11H14N2O5S/c1-11(2,3)12-8(14)6-18-10(15)7-4-5-9(19-7)13(16)17/h4-5H,6H2,1-3H3,(H,12,14)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chiba University Curated by ChEMBL					Assay Description Inhibition RNase H activity of HIV1 reverse transcriptase expressed in Escherichia coli stain BL21(DE3)pLysS				Bioorg Med Chem 19: 816-25 (2011) Article DOI: 10.1016/j.bmc.2010.12.011 BindingDB Entry DOI: 10.7270/Q2JH3Q11
					More data for this Ligand-Target Pair
Bis(5'-adenosyl)-triphosphatase (Homo sapiens (Human))	BDBM50580667 (CHEMBL5069986) Show SMILES COc1c(OCC(=O)NO)ccc2c3CCCCc3c(=O)oc12 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human FHIT incubated for 1hr in presence of tokyogreen-labeled CMP probe by fluorescence based analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00874 BindingDB Entry DOI: 10.7270/Q2571GVZ
					More data for this Ligand-Target Pair

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