Found 50 hits Enz. Inhib. hit(s) with Target = 'Ectonucleoside triphosphate diphosphohydrolase 2' 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 |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262249
(4-[2-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimi...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)cc1)OCC |r| Show InChI InChI=1S/C22H29N4O10P/c1-3-34-37(33,35-4-2)12-13-5-7-14(8-6-13)24-16(28)11-23-20(31)19-17(29)18(30)21(36-19)26-10-9-15(27)25-22(26)32/h5-10,17-19,21,29-30H,3-4,11-12H2,1-2H3,(H,23,31)(H,24,28)(H,25,27,32)/t17-,18+,19-,21+/m0/s1 | KEGG
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| Article PubMed
| 8.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50227019
(CHEMBL271673 | sodium 1-amino-4-(4-chlorophenylami...)Show SMILES Nc1c(cc(Nc2ccc(Cl)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C20H13ClN2O5S/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25/h1-9,23H,22H2,(H,26,27,28)/p-1 | PDB MMDB
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| 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of rat NTPDase2 expressed in CHO cells using ATP as substrate incubated for 10 mins by UV absorbance method |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01044 BindingDB Entry DOI: 10.7270/Q2B27ZZ6 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50378649
(CHEMBL597197)Show SMILES Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccc3ccccc3c2)cc1S([O-])(=O)=O Show InChI InChI=1S/C24H16N2O5S/c25-22-19(32(29,30)31)12-18(26-15-10-9-13-5-1-2-6-14(13)11-15)20-21(22)24(28)17-8-4-3-7-16(17)23(20)27/h1-12,26H,25H2,(H,29,30,31)/p-1 | PDB MMDB
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| 1.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of rat NTPDase2 expressed in CHO cells using ATP as substrate incubated for 10 mins by UV absorbance method |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01044 BindingDB Entry DOI: 10.7270/Q2B27ZZ6 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50048062
(CHEMBL3314932)Show SMILES CCCCCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]3O)c2n1 |r| Show InChI InChI=1S/C17H30N5O12P3S/c1-2-3-4-5-6-38-17-20-14(18)11-15(21-17)22(8-19-11)16-13(24)12(23)10(33-16)7-32-37(30,31)34-36(28,29)9-35(25,26)27/h8,10,12-13,16,23-24H,2-7,9H2,1H3,(H,28,29)(H,30,31)(H2,18,20,21)(H2,25,26,27)/t10-,12-,13-,16-/m1/s1 | KEGG
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| 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bar-Ilan University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human NTPDase2 transfected in COS-7 cells using ATP substrate |
J Med Chem 57: 5919-34 (2014)
Article DOI: 10.1021/jm401933c BindingDB Entry DOI: 10.7270/Q2B27WXX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50029031
(1-Amino-4-{4-[4-chloro-6-(3-sulfo-phenylamino)-[1,...)Show SMILES Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(c4)S([O-])(=O)=O)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-9-8-14(11-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/p-3 | PDB MMDB
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| 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant NTPDase2 expressed in CHO cells |
Bioorg Med Chem Lett 16: 5943-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.09.003 BindingDB Entry DOI: 10.7270/Q27H1KC9 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50029031
(1-Amino-4-{4-[4-chloro-6-(3-sulfo-phenylamino)-[1,...)Show SMILES Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(c4)S([O-])(=O)=O)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-9-8-14(11-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/p-3 | PDB MMDB
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| 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPDase 2 |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50552129
(CHEMBL4744335)Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[#7]-c1c(cc(-[#7]-c2ccc(-[#7]-c3nc(Cl)nc(-[#7]-c4ccc(c(c4)S([#8-])(=O)=O)S([#8-])(=O)=O)n3)c(c2)S([#8-])(=O)=O)c2-[#6](=O)-c3ccccc3-[#6](=O)-c12)S([#8-])(=O)=O | PDB MMDB
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| 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of rat NTPDase2 expressed in CHO cells using ATP as substrate incubated for 10 mins by UV absorbance method |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01044 BindingDB Entry DOI: 10.7270/Q2B27ZZ6 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50029031
(1-Amino-4-{4-[4-chloro-6-(3-sulfo-phenylamino)-[1,...)Show SMILES Nc1c(cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(c4)S([O-])(=O)=O)n3)c(c2)S([O-])(=O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C29H20ClN7O11S3/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-9-8-14(11-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/p-3 | PDB MMDB
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| 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262311
(4-[(2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin...)Show SMILES CCOP(=O)(CNC(=O)CCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C18H29N4O10P/c1-3-30-33(29,31-4-2)10-20-11(23)6-5-8-19-16(27)15-13(25)14(26)17(32-15)22-9-7-12(24)21-18(22)28/h7,9,13-15,17,25-26H,3-6,8,10H2,1-2H3,(H,19,27)(H,20,23)(H,21,24,28)/t13-,14+,15-,17+/m0/s1 | KEGG
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| 2.92E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50227032
(CHEMBL256057 | acid blue 25 | sodium 1-amino-9,10-...)Show SMILES Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccccc2)cc1S([O-])(=O)=O Show InChI InChI=1S/C20H14N2O5S/c21-18-15(28(25,26)27)10-14(22-11-6-2-1-3-7-11)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h1-10,22H,21H2,(H,25,26,27)/p-1 | PDB MMDB
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| 3.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50262422
(CHEMBL477339 | sodium (E)-4-((3-formyl-4-hydroxy-5...)Show SMILES Cc1cc(N=Nc2ccc(cc2S([O-])(=O)=O)S([O-])(=O)=O)c(COP([O-])([O-])=O)c(C=O)c1O |w:4.3| Show InChI InChI=1S/C15H15N2O12PS2/c1-8-4-13(11(7-29-30(20,21)22)10(6-18)15(8)19)17-16-12-3-2-9(31(23,24)25)5-14(12)32(26,27)28/h2-6,19H,7H2,1H3,(H2,20,21,22)(H,23,24,25)(H,26,27,28)/p-4 | PDB MMDB
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| 4.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPDase 2 |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50336799
(5,5',5''-[1,3,6-naphthalenetriyltris(sulfonylimino...)Show SMILES Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O Show InChI InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80) | PDB MMDB
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| 6.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPDase 2 |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50336799
(5,5',5''-[1,3,6-naphthalenetriyltris(sulfonylimino...)Show SMILES Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O Show InChI InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80) | PDB MMDB
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| 6.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant NTPDase2 expressed in CHO cells |
Bioorg Med Chem Lett 16: 5943-7 (2006)
Article DOI: 10.1016/j.bmcl.2006.09.003 BindingDB Entry DOI: 10.7270/Q27H1KC9 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262252
(2-[(2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin...)Show SMILES CCOP(=O)(CNC(=O)CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C16H25N4O10P/c1-3-28-31(27,29-4-2)8-18-10(22)7-17-14(25)13-11(23)12(24)15(30-13)20-6-5-9(21)19-16(20)26/h5-6,11-13,15,23-24H,3-4,7-8H2,1-2H3,(H,17,25)(H,18,22)(H,19,21,26)/t11-,12+,13-,15+/m0/s1 | KEGG
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| Article PubMed
| 7.17E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262312
(2-[2-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimi...)Show SMILES CCOP(=O)(CCNC(=O)CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C17H27N4O10P/c1-3-29-32(28,30-4-2)8-6-18-11(23)9-19-15(26)14-12(24)13(25)16(31-14)21-7-5-10(22)20-17(21)27/h5,7,12-14,16,24-25H,3-4,6,8-9H2,1-2H3,(H,18,23)(H,19,26)(H,20,22,27)/t12-,13+,14-,16+/m0/s1 | KEGG
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| 1.16E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262310
(3-[(2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin...)Show SMILES CCOP(=O)(CNC(=O)CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C17H27N4O10P/c1-3-29-32(28,30-4-2)9-19-10(22)5-7-18-15(26)14-12(24)13(25)16(31-14)21-8-6-11(23)20-17(21)27/h6,8,12-14,16,24-25H,3-5,7,9H2,1-2H3,(H,18,26)(H,19,22)(H,20,23,27)/t12-,13+,14-,16+/m0/s1 | KEGG
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| Article PubMed
| 1.67E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262250
(4-[3-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimi...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CCNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)cc1)OCC |r| Show InChI InChI=1S/C23H31N4O10P/c1-3-35-38(34,36-4-2)13-14-5-7-15(8-6-14)25-16(28)9-11-24-21(32)20-18(30)19(31)22(37-20)27-12-10-17(29)26-23(27)33/h5-8,10,12,18-20,22,30-31H,3-4,9,11,13H2,1-2H3,(H,24,32)(H,25,28)(H,26,29,33)/t18-,19+,20-,22+/m0/s1 | KEGG
UniProtKB/SwissProt
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| 1.73E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50307836
(CHEMBL608559 | Sodium 1-Amino-4-(2-anthracenylamin...)Show SMILES Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2ccc3cc4ccccc4cc3c2)cc1S([O-])(=O)=O Show InChI InChI=1S/C28H18N2O5S/c29-26-23(36(33,34)35)14-22(24-25(26)28(32)21-8-4-3-7-20(21)27(24)31)30-19-10-9-17-11-15-5-1-2-6-16(15)12-18(17)13-19/h1-14,30H,29H2,(H,33,34,35)/p-1 | KEGG
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| >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50307835
(CHEMBL590956 | Sodium 1-amino-4-[4-fluoro-2-carbox...)Show SMILES Nc1c(cc(Nc2ccc(F)cc2C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C21H13FN2O7S/c22-9-5-6-13(12(7-9)21(27)28)24-14-8-15(32(29,30)31)18(23)17-16(14)19(25)10-3-1-2-4-11(10)20(17)26/h1-8,24H,23H2,(H,27,28)(H,29,30,31)/p-1 | KEGG
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| >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50268725
(CHEMBL496030 | sodium 1-amino-4-(4-hydroxyphenylam...)Show SMILES Nc1c(cc(Nc2ccc(O)cc2)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O Show InChI InChI=1S/C20H14N2O6S/c21-18-15(29(26,27)28)9-14(22-10-5-7-11(23)8-6-10)16-17(18)20(25)13-4-2-1-3-12(13)19(16)24/h1-9,22-23H,21H2,(H,26,27,28)/p-1 | KEGG
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| >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262251
(4-[4-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimi...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CCCNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)cc1)OCC |r| Show InChI InChI=1S/C24H33N4O10P/c1-3-36-39(35,37-4-2)14-15-7-9-16(10-8-15)26-17(29)6-5-12-25-22(33)21-19(31)20(32)23(38-21)28-13-11-18(30)27-24(28)34/h7-11,13,19-21,23,31-32H,3-6,12,14H2,1-2H3,(H,25,33)(H,26,29)(H,27,30,34)/t19-,20+,21-,23+/m0/s1 | KEGG
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| 2.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262373
(4-[4-((2S,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CCCNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1)OCC |r| Show InChI InChI=1S/C25H34N7O8P/c1-3-38-41(37,39-4-2)12-15-7-9-16(10-8-15)31-17(33)6-5-11-27-24(36)21-19(34)20(35)25(40-21)32-14-30-18-22(26)28-13-29-23(18)32/h7-10,13-14,19-21,25,34-35H,3-6,11-12H2,1-2H3,(H,27,36)(H,31,33)(H2,26,28,29)/t19-,20+,21-,25+/m0/s1 | KEGG
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| 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Rattus norvegicus) | BDBM50268574
(CHEMBL498423 | Sodium 1-Amino-4-(1-naphthylamino)-...)Show SMILES Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2cccc3ccccc23)cc1S([O-])(=O)=O Show InChI InChI=1S/C24H16N2O5S/c25-22-19(32(29,30)31)12-18(26-17-11-5-7-13-6-1-2-8-14(13)17)20-21(22)24(28)16-10-4-3-9-15(16)23(20)27/h1-12,26H,25H2,(H,29,30,31)/p-1 | PDB MMDB
KEGG
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| >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of rat NTPdase2 by capillary electrophoresis method |
J Med Chem 53: 2076-86 (2010)
Article DOI: 10.1021/jm901851t BindingDB Entry DOI: 10.7270/Q2DZ097V |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262372
(4-[3-((2S,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CCNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1)OCC |r| Show InChI InChI=1S/C24H32N7O8P/c1-3-37-40(36,38-4-2)11-14-5-7-15(8-6-14)30-16(32)9-10-26-23(35)20-18(33)19(34)24(39-20)31-13-29-17-21(25)27-12-28-22(17)31/h5-8,12-13,18-20,24,33-34H,3-4,9-11H2,1-2H3,(H,26,35)(H,30,32)(H2,25,27,28)/t18-,19+,20-,24+/m0/s1 | KEGG
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| 1.44E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50546288
(CHEMBL4743437)Show SMILES C[C@H](Nc1nc(Cl)nc2n(ncc12)[C@@H]1O[C@H](COP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]1O)c1ccccc1 |r| | KEGG
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| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of NTPDase 2 (unknown origin) expressed in CHO cells using ATP as substrate preincubated for 1 hr followed by substrate addition and measu... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c00525 BindingDB Entry DOI: 10.7270/Q29W0K29 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50527134
(CHEMBL4471306 | US20230295213, Compound a)Show SMILES C[C@H](Nc1cc(Cl)nc2n(ncc12)[C@@H]1O[C@H](COP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]1O)c1ccccc1F |r| Show InChI InChI=1S/C20H24ClFN4O9P2/c1-10(11-4-2-3-5-13(11)22)24-14-6-16(21)25-19-12(14)7-23-26(19)20-18(28)17(27)15(35-20)8-34-37(32,33)9-36(29,30)31/h2-7,10,15,17-18,20,27-28H,8-9H2,1H3,(H,24,25)(H,32,33)(H2,29,30,31)/t10-,15+,17+,18+,20+/m0/s1 | KEGG
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| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of NTPDase 2 (unknown origin) expressed in CHO cells using ATP as substrate preincubated for 1 hr followed by substrate addition and measu... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c00525 BindingDB Entry DOI: 10.7270/Q29W0K29 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50546280
(CHEMBL4761506)Show SMILES C[C@H](Nc1cc(Cl)nc2n(ncc12)[C@@H]1O[C@H](COP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]1O)c1ccc(F)cc1 |r| | KEGG
UniProtKB/SwissProt
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| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of NTPDase 2 (unknown origin) expressed in CHO cells using ATP as substrate preincubated for 1 hr followed by substrate addition and measu... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c00525 BindingDB Entry DOI: 10.7270/Q29W0K29 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50187685
(CHEMBL597418)Show SMILES [Na+].Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2cc3ccccc3c3ccccc23)cc1S([O-])(=O)=O Show InChI InChI=1S/C28H18N2O5S.Na/c29-26-23(36(33,34)35)14-22(24-25(26)28(32)20-12-6-5-11-19(20)27(24)31)30-21-13-15-7-1-2-8-16(15)17-9-3-4-10-18(17)21;/h1-14,30H,29H2,(H,33,34,35);/q;+1/p-1 | KEGG
UniProtKB/SwissProt
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| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of recombinant human NTPDase2 expressed in CHO cells using ADP as substrate incubated for 10 mins by capillary electrophoresis method |
Bioorg Med Chem 24: 4363-4371 (2016)
Article DOI: 10.1016/j.bmc.2016.07.027 BindingDB Entry DOI: 10.7270/Q2GQ70Q8 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50552128
(CHEMBL4787368)Show SMILES OS(=O)(=O)C1=CC\C(=N/C(=O)C2=C\C(C=CC2)=N\C(=O)C2=CC=C\C(C2)=N/C(=O)/N=C2/CC(=CC=C2)C(=O)\N=C2\CC(=CC=C2)C(=O)\N=C2/CC=C(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c2c1cc(cc2S(O)(=O)=O)S(O)(=O)=O |c:14,23,34,36,44,46,54,t:4,11,21| | KEGG
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| Article PubMed
| n/a | n/a | 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of human NTPDase2 expressed in green monkey Cos-7 cells using ATP as substrate preincubated for 3 mins followed by substrate addition by m... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01044 BindingDB Entry DOI: 10.7270/Q2B27ZZ6 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50561221
(CHEMBL4745473 | US11377469, Example 95)Show SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COCP(O)(O)=O)n1ncc2c(NC3CCCC3)nc(Cl)nc12 |r| | KEGG
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| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of human NTPDase-2 expressed in CHO-K1 cells in presence of DNA/LTX mixture |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01835 BindingDB Entry DOI: 10.7270/Q2NG4VF1 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50527649
(CHEMBL4467828)Show SMILES Clc1cc(cc2n(nnc12)-c1ccc2cn[nH]c2c1)-c1ccnn1Cc1ccc(cc1)C#N Show InChI InChI=1S/C24H15ClN8/c25-20-9-18(22-7-8-28-32(22)14-16-3-1-15(12-26)2-4-16)10-23-24(20)30-31-33(23)19-6-5-17-13-27-29-21(17)11-19/h1-11,13H,14H2,(H,27,29) | KEGG
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| n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Arcus Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in CHO cells using ATP as substrate preincubated for 1 hr followed by substrate addition and measured after 5... |
J Med Chem 63: 3935-3955 (2020)
Article DOI: 10.1021/acs.jmedchem.9b01713 BindingDB Entry DOI: 10.7270/Q2G1648T |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50179360
(CHEMBL3040216)Show SMILES CC1=CCC(=C\C1=N\C(=O)C1=CC=C\C(C1)=N/C(=O)/N=C1/CC(=CC=C1)C(=O)\N=C1\CC(=CC=C1C)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O |c:4,13,24,26,34,36,45,72,t:1,11| Show InChI InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-11,15-16,20-24H,12-14,17-19H2,1-2H3,(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/b52-31+,53-32+,54-37+,55-38+,56-39-,57-40- | KEGG
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| Article PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of human NTPDase2 expressed in green monkey Cos-7 cells using ATP as substrate preincubated for 3 mins followed by substrate addition by m... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01044 BindingDB Entry DOI: 10.7270/Q2B27ZZ6 |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50179360
(CHEMBL3040216)Show SMILES CC1=CCC(=C\C1=N\C(=O)C1=CC=C\C(C1)=N/C(=O)/N=C1/CC(=CC=C1)C(=O)\N=C1\CC(=CC=C1C)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O |c:4,13,24,26,34,36,45,72,t:1,11| Show InChI InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-11,15-16,20-24H,12-14,17-19H2,1-2H3,(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/b52-31+,53-32+,54-37+,55-38+,56-39-,57-40- | KEGG
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| n/a | n/a | 2.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50048062
(CHEMBL3314932)Show SMILES CCCCCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]3O)c2n1 |r| Show InChI InChI=1S/C17H30N5O12P3S/c1-2-3-4-5-6-38-17-20-14(18)11-15(21-17)22(8-19-11)16-13(24)12(23)10(33-16)7-32-37(30,31)34-36(28,29)9-35(25,26)27/h8,10,12-13,16,23-24H,2-7,9H2,1H3,(H,28,29)(H,30,31)(H2,18,20,21)(H2,25,26,27)/t10-,12-,13-,16-/m1/s1 | KEGG
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Patents
Similars
| Article PubMed
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Bar-Ilan University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human NTPDase2 transfected in COS-7 cells using ATP substrate |
J Med Chem 57: 5919-34 (2014)
Article DOI: 10.1021/jm401933c BindingDB Entry DOI: 10.7270/Q2B27WXX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262249
(4-[2-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimi...)Show SMILES CCOP(=O)(Cc1ccc(NC(=O)CNC(=O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)cc1)OCC |r| Show InChI InChI=1S/C22H29N4O10P/c1-3-34-37(33,35-4-2)12-13-5-7-14(8-6-13)24-16(28)11-23-20(31)19-17(29)18(30)21(36-19)26-10-9-15(27)25-22(26)32/h5-10,17-19,21,29-30H,3-4,11-12H2,1-2H3,(H,23,31)(H,24,28)(H,25,27,32)/t17-,18+,19-,21+/m0/s1 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 4.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells assessed as residual activity by capillary electrophoresis |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262311
(4-[(2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin...)Show SMILES CCOP(=O)(CNC(=O)CCCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C18H29N4O10P/c1-3-30-33(29,31-4-2)10-20-11(23)6-5-8-19-16(27)15-13(25)14(26)17(32-15)22-9-7-12(24)21-18(22)28/h7,9,13-15,17,25-26H,3-6,8,10H2,1-2H3,(H,19,27)(H,20,23)(H,21,24,28)/t13-,14+,15-,17+/m0/s1 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.01E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells assessed as residual activity by capillary electrophoresis |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276785
(CHEMBL4164185)Show SMILES Fc1ccc(cc1)-c1cccc2c(-c3ccc(F)cc3)c(-c3ccc(F)cc3)c(nc12)C(F)(F)F Show InChI InChI=1S/C28H15F6N/c29-19-10-4-16(5-11-19)22-2-1-3-23-24(17-6-12-20(30)13-7-17)25(18-8-14-21(31)15-9-18)27(28(32,33)34)35-26(22)23/h1-15H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276790
(CHEMBL4174849)Show SMILES COc1ccc(cc1)-c1cccc2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)c(nc12)C(F)(F)F Show InChI InChI=1S/C31H24F3NO3/c1-36-22-13-7-19(8-14-22)25-5-4-6-26-27(20-9-15-23(37-2)16-10-20)28(21-11-17-24(38-3)18-12-21)30(31(32,33)34)35-29(25)26/h4-18H,1-3H3 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276791
(CHEMBL4164891)Show SMILES FC(F)(F)c1nc2c(cccc2c(Cl)c1Br)-c1cccc(c1)C#N Show InChI InChI=1S/C17H7BrClF3N2/c18-13-14(19)12-6-2-5-11(10-4-1-3-9(7-10)8-23)15(12)24-16(13)17(20,21)22/h1-7H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276780
(CHEMBL4172933)Show SMILES COc1ccc(cc1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F Show InChI InChI=1S/C17H10BrClF3NO/c1-24-10-7-5-9(6-8-10)11-3-2-4-12-14(19)13(18)16(17(20,21)22)23-15(11)12/h2-8H,1H3 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276789
(CHEMBL4175913)Show InChI InChI=1S/C10H4Br2F3NO/c11-5-3-1-2-4-7(5)16-9(10(13,14)15)6(12)8(4)17/h1-3H,(H,16,17) | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276788
(CHEMBL4162261)Show SMILES COc1ccc(OC)c(c1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F Show InChI InChI=1S/C18H12BrClF3NO2/c1-25-9-6-7-13(26-2)12(8-9)10-4-3-5-11-15(20)14(19)17(18(21,22)23)24-16(10)11/h3-8H,1-2H3 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276782
(CHEMBL4165654)Show InChI InChI=1S/C14H6BrClF3NS/c15-10-11(16)9-3-1-2-8(7-4-5-21-6-7)12(9)20-13(10)14(17,18)19/h1-6H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276783
(CHEMBL4169839)Show SMILES FC(F)(F)c1nc2c(cccc2c(-c2ccccc2)c1-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C28H18F3N/c29-28(30,31)27-25(21-15-8-3-9-16-21)24(20-13-6-2-7-14-20)23-18-10-17-22(26(23)32-27)19-11-4-1-5-12-19/h1-18H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276784
(CHEMBL4159530)Show InChI InChI=1S/C10H3Br2ClF3N/c11-5-3-1-2-4-7(13)6(12)9(10(14,15)16)17-8(4)5/h1-3H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276781
(CHEMBL4159729)Show SMILES Cc1cccc(c1)-c1cccc2c(-c3cccc(C)c3)c(-c3cccc(C)c3)c(nc12)C(F)(F)F Show InChI InChI=1S/C31H24F3N/c1-19-8-4-11-22(16-19)25-14-7-15-26-27(23-12-5-9-20(2)17-23)28(24-13-6-10-21(3)18-24)30(31(32,33)34)35-29(25)26/h4-18H,1-3H3 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276787
(CHEMBL4173693)Show SMILES Cc1ccc(cc1)-c1cccc2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(nc12)C(F)(F)F Show InChI InChI=1S/C31H24F3N/c1-19-7-13-22(14-8-19)25-5-4-6-26-27(23-15-9-20(2)10-16-23)28(24-17-11-21(3)12-18-24)30(31(32,33)34)35-29(25)26/h4-18H,1-3H3 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276786
(CHEMBL4172790)Show SMILES FC(F)(F)c1ccc(cc1)-c1cccc2c(Cl)c(Br)c(nc12)C(F)(F)F Show InChI InChI=1S/C17H7BrClF6N/c18-12-13(19)11-3-1-2-10(14(11)26-15(12)17(23,24)25)8-4-6-9(7-5-8)16(20,21)22/h1-7H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50276794
(CHEMBL4161473)Show SMILES FC(F)(F)c1nc2c(cccc2c(Cl)c1-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C22H13ClF3N/c23-19-17-13-7-12-16(14-8-3-1-4-9-14)20(17)27-21(22(24,25)26)18(19)15-10-5-2-6-11-15/h1-13H | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£t Rostock
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase2 expressed in African green monkey COS7 cell membrane fraction using ATP as substrate preincubated for 10 mins followed b... |
Eur J Med Chem 138: 816-829 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.017 BindingDB Entry DOI: 10.7270/Q20R9RXT |
More data for this Ligand-Target Pair | |
Ectonucleoside triphosphate diphosphohydrolase 2
(Homo sapiens (Human)) | BDBM50262252
(2-[(2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin...)Show SMILES CCOP(=O)(CNC(=O)CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(=O)[nH]c1=O)OCC |r| Show InChI InChI=1S/C16H25N4O10P/c1-3-28-31(27,29-4-2)8-18-10(22)7-17-14(25)13-11(23)12(24)15(30-13)20-6-5-9(21)19-16(20)26/h5-6,11-13,15,23-24H,3-4,7-8H2,1-2H3,(H,17,25)(H,18,22)(H,19,21,26)/t11-,12+,13-,15+/m0/s1 | KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.74E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn
Curated by ChEMBL
| Assay Description Inhibition of human NTPDase 2 expressed in HEK293 cells assessed as residual activity by capillary electrophoresis |
J Med Chem 51: 4518-28 (2008)
Article DOI: 10.1021/jm800175e BindingDB Entry DOI: 10.7270/Q2XW4KQX |
More data for this Ligand-Target Pair | |