Compile Data Set for Download or QSAR

Found 77 hits with Last Name = 'weidlich' and Initial = 'i'   

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
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378673 (CHEMBL591472 | NSC-128609) Show SMILES O=c1n(-c2cccc3c2ccc2c4ccccc4ccc32)c(=O)c2ccccc2c2ccccc12 |(14.44,-11.65,;15.68,-10.73,;17.1,-11.5,;17.11,-13.04,;18.44,-13.79,;18.46,-15.33,;17.13,-16.1,;15.8,-15.35,;15.8,-13.81,;14.46,-13.06,;13.14,-13.83,;13.15,-15.36,;11.82,-16.14,;10.48,-15.37,;9.15,-16.14,;9.15,-17.69,;10.49,-18.47,;11.82,-17.69,;13.16,-18.46,;14.5,-17.68,;14.49,-16.12,;18.52,-10.87,;19.7,-11.87,;18.9,-9.36,;20.48,-9.13,;21.06,-7.65,;20.07,-6.4,;18.49,-6.63,;17.91,-8.11,;16.4,-8.12,;15.89,-6.69,;14.39,-6.41,;13.4,-7.59,;13.92,-9.02,;15.41,-9.29,)| Show InChI InChI=1S/C32H19NO2/c34-31-28-12-5-3-10-23(28)24-11-4-6-13-29(24)32(35)33(31)30-15-7-14-22-26-17-16-20-8-1-2-9-21(20)25(26)18-19-27(22)30/h1-19H	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276388 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C28H43N6O10P/c1-5-6-13-34(16-25(37)32-22(26(30)38)14-17(2)3)28(40)21(11-12-24(29)36)33-27(39)23(31-18(4)35)15-19-7-9-20(10-8-19)44-45(41,42)43/h5,7-10,17,21-23H,1,6,11-16H2,2-4H3,(H2,29,36)(H2,30,38)(H,31,35)(H,32,37)(H,33,39)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50158383 (2-((8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)COS(=O)(=O)c1ccc(Br)cc1 |r,t:8| Show InChI InChI=1S/C27H33BrO5S/c1-26-13-11-19(29)15-17(26)3-8-21-22-9-10-24(27(22,2)14-12-23(21)26)25(30)16-33-34(31,32)20-6-4-18(28)5-7-20/h4-7,15,21-24H,3,8-14,16H2,1-2H3/t21-,22-,23-,24+,26-,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human Tdp1 expressed in Escherichia coli assessed as blockade of enzyme-mediated hydrolysis of phosphodiester linkage between tyrosine ...				J Med Chem 52: 7122-31 (2009) Article DOI: 10.1021/jm901061s BindingDB Entry DOI: 10.7270/Q2H1325T
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378674 (CHEMBL601283) Show SMILES CCOC(=O)CN(C(=O)COC(=O)Cc1c[nH]c2ccccc12)c1ccc(F)cc1 Show InChI InChI=1S/C22H21FN2O5/c1-2-29-22(28)13-25(17-9-7-16(23)8-10-17)20(26)14-30-21(27)11-15-12-24-19-6-4-3-5-18(15)19/h3-10,12,24H,2,11,13-14H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276339 (4-((2S,5S,11S,14S)-2-acetamido-5-(3-amino-3-oxopro...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)NCCC=C |r| Show InChI InChI=1S/C35H54N7O12P/c1-6-8-16-37-32(47)29(21-43)41-33(48)27(18-22(3)4)39-31(46)20-42(17-9-7-2)35(50)26(14-15-30(36)45)40-34(49)28(38-23(5)44)19-24-10-12-25(13-11-24)54-55(51,52)53/h6-7,10-13,22,26-29,43H,1-2,8-9,14-21H2,3-5H3,(H2,36,45)(H,37,47)(H,38,44)(H,39,46)(H,40,49)(H,41,48)(H2,51,52,53)/t26-,27-,28-,29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50158383 (2-((8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)COS(=O)(=O)c1ccc(Br)cc1 |r,t:8| Show InChI InChI=1S/C27H33BrO5S/c1-26-13-11-19(29)15-17(26)3-8-21-22-9-10-24(27(22,2)14-12-23(21)26)25(30)16-33-34(31,32)20-6-4-18(28)5-7-20/h4-7,15,21-24H,3,8-14,16H2,1-2H3/t21-,22-,23-,24+,26-,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276387 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C28H45N6O10P/c1-5-6-13-34(16-25(37)32-22(26(30)38)14-17(2)3)28(40)21(11-12-24(29)36)33-27(39)23(31-18(4)35)15-19-7-9-20(10-8-19)44-45(41,42)43/h7-10,17,21-23H,5-6,11-16H2,1-4H3,(H2,29,36)(H2,30,38)(H,31,35)(H,32,37)(H,33,39)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276396 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCCCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C29H47N6O10P/c1-5-6-7-14-35(17-26(38)33-23(27(31)39)15-18(2)3)29(41)22(12-13-25(30)37)34-28(40)24(32-19(4)36)16-20-8-10-21(11-9-20)45-46(42,43)44/h8-11,18,22-24H,5-7,12-17H2,1-4H3,(H2,30,37)(H2,31,39)(H,32,36)(H,33,38)(H,34,40)(H2,42,43,44)/t22-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378674 (CHEMBL601283) Show SMILES CCOC(=O)CN(C(=O)COC(=O)Cc1c[nH]c2ccccc12)c1ccc(F)cc1 Show InChI InChI=1S/C22H21FN2O5/c1-2-29-22(28)13-25(17-9-7-16(23)8-10-17)20(26)14-30-21(27)11-15-12-24-19-6-4-3-5-18(15)19/h3-10,12,24H,2,11,13-14H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276402 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCCCC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C30H47N6O10P/c1-5-6-7-8-15-36(18-27(39)34-24(28(32)40)16-19(2)3)30(42)23(13-14-26(31)38)35-29(41)25(33-20(4)37)17-21-9-11-22(12-10-21)46-47(43,44)45/h5,9-12,19,23-25H,1,6-8,13-18H2,2-4H3,(H2,31,38)(H2,32,40)(H,33,37)(H,34,39)(H,35,41)(H2,43,44,45)/t23-,24-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378672 (CHEMBL601298 | NSC-120686) Show SMILES Fc1cccc(Cl)c1\[#6]=[#7]\[#7]=[#6]-1/c2ccccc2-c2ccccc-12 Show InChI InChI=1S/C20H12ClFN2/c21-18-10-5-11-19(22)17(18)12-23-24-20-15-8-3-1-6-13(15)14-7-2-4-9-16(14)20/h1-12H/b23-12+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276346 (4-((2S,5S,11S)-2-acetamido-5-(3-amino-3-oxopropyl)...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCCC=C |r| Show InChI InChI=1S/C32H49N6O10P/c1-6-8-16-34-30(42)26(18-21(3)4)36-29(41)20-38(17-9-7-2)32(44)25(14-15-28(33)40)37-31(43)27(35-22(5)39)19-23-10-12-24(13-11-23)48-49(45,46)47/h6-7,10-13,21,25-27H,1-2,8-9,14-20H2,3-5H3,(H2,33,40)(H,34,42)(H,35,39)(H,36,41)(H,37,43)(H2,45,46,47)/t25-,26-,27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378675 (CHEMBL591964) Show SMILES CCOc1cccc2cc(C(=O)OCC(=O)c3c[nH]c4ccccc34)c(=O)oc12 Show InChI InChI=1S/C22H17NO6/c1-2-27-19-9-5-6-13-10-15(22(26)29-20(13)19)21(25)28-12-18(24)16-11-23-17-8-4-3-7-14(16)17/h3-11,23H,2,12H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276397 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCCC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C29H45N6O10P/c1-5-6-7-14-35(17-26(38)33-23(27(31)39)15-18(2)3)29(41)22(12-13-25(30)37)34-28(40)24(32-19(4)36)16-20-8-10-21(11-9-20)45-46(42,43)44/h5,8-11,18,22-24H,1,6-7,12-17H2,2-4H3,(H2,30,37)(H2,31,39)(H,32,36)(H,33,38)(H,34,40)(H2,42,43,44)/t22-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276398 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCC#CCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C29H43N6O10P/c1-5-6-7-14-35(17-26(38)33-23(27(31)39)15-18(2)3)29(41)22(12-13-25(30)37)34-28(40)24(32-19(4)36)16-20-8-10-21(11-9-20)45-46(42,43)44/h8-11,18,22-24H,5,12-17H2,1-4H3,(H2,30,37)(H2,31,39)(H,32,36)(H,33,38)(H,34,40)(H2,42,43,44)/t22-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276391 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)CCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C29H47N6O10P/c1-17(2)12-13-35(16-26(38)33-23(27(31)39)14-18(3)4)29(41)22(10-11-25(30)37)34-28(40)24(32-19(5)36)15-20-6-8-21(9-7-20)45-46(42,43)44/h6-9,17-18,22-24H,10-16H2,1-5H3,(H2,30,37)(H2,31,39)(H,32,36)(H,33,38)(H,34,40)(H2,42,43,44)/t22-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276389 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(Cc1ccccc1)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C31H43N6O10P/c1-19(2)15-25(29(33)41)35-28(40)18-37(17-22-7-5-4-6-8-22)31(43)24(13-14-27(32)39)36-30(42)26(34-20(3)38)16-21-9-11-23(12-10-21)47-48(44,45)46/h4-12,19,24-26H,13-18H2,1-3H3,(H2,32,39)(H2,33,41)(H,34,38)(H,35,40)(H,36,42)(H2,44,45,46)/t24-,25-,26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276384 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C26H41N6O10P/c1-5-32(14-23(35)30-20(24(28)36)12-15(2)3)26(38)19(10-11-22(27)34)31-25(37)21(29-16(4)33)13-17-6-8-18(9-7-17)42-43(39,40)41/h6-9,15,19-21H,5,10-14H2,1-4H3,(H2,27,34)(H2,28,36)(H,29,33)(H,30,35)(H,31,37)(H2,39,40,41)/t19-,20-,21-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276401 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCCCCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C30H49N6O10P/c1-5-6-7-8-15-36(18-27(39)34-24(28(32)40)16-19(2)3)30(42)23(13-14-26(31)38)35-29(41)25(33-20(4)37)17-21-9-11-22(12-10-21)46-47(43,44)45/h9-12,19,23-25H,5-8,13-18H2,1-4H3,(H2,31,38)(H2,32,40)(H,33,37)(H,34,39)(H,35,41)(H2,43,44,45)/t23-,24-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378675 (CHEMBL591964) Show SMILES CCOc1cccc2cc(C(=O)OCC(=O)c3c[nH]c4ccccc34)c(=O)oc12 Show InChI InChI=1S/C22H17NO6/c1-2-27-19-9-5-6-13-10-15(22(26)29-20(13)19)21(25)28-12-18(24)16-11-23-17-8-4-3-7-14(16)17/h3-11,23H,2,12H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276393 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCCC(F)(F)F)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C28H42F3N6O10P/c1-16(2)13-21(25(33)41)35-24(40)15-37(12-4-11-28(29,30)31)27(43)20(9-10-23(32)39)36-26(42)22(34-17(3)38)14-18-5-7-19(8-6-18)47-48(44,45)46/h5-8,16,20-22H,4,9-15H2,1-3H3,(H2,32,39)(H2,33,41)(H,34,38)(H,35,40)(H,36,42)(H2,44,45,46)/t20-,21-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276385 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C27H43N6O10P/c1-5-12-33(15-24(36)31-21(25(29)37)13-16(2)3)27(39)20(10-11-23(28)35)32-26(38)22(30-17(4)34)14-18-6-8-19(9-7-18)43-44(40,41)42/h6-9,16,20-22H,5,10-15H2,1-4H3,(H2,28,35)(H2,29,37)(H,30,34)(H,31,36)(H,32,38)(H2,40,41,42)/t20-,21-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276386 (4-((S)-2-acetamido-3-((S)-1-(allyl(2-((S)-1-amino-...) Show SMILES CC(C)C[C@H](NC(=O)CN(CC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C27H41N6O10P/c1-5-12-33(15-24(36)31-21(25(29)37)13-16(2)3)27(39)20(10-11-23(28)35)32-26(38)22(30-17(4)34)14-18-6-8-19(9-7-18)43-44(40,41)42/h5-9,16,20-22H,1,10-15H2,2-4H3,(H2,28,35)(H2,29,37)(H,30,34)(H,31,36)(H,32,38)(H2,40,41,42)/t20-,21-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276395 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)CCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C30H49N6O10P/c1-18(2)7-6-14-36(17-27(39)34-24(28(32)40)15-19(3)4)30(42)23(12-13-26(31)38)35-29(41)25(33-20(5)37)16-21-8-10-22(11-9-21)46-47(43,44)45/h8-11,18-19,23-25H,6-7,12-17H2,1-5H3,(H2,31,38)(H2,32,40)(H,33,37)(H,34,39)(H,35,41)(H2,43,44,45)/t23-,24-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378676 (CHEMBL591965) Show SMILES FC(F)(F)c1ccc(\C=C\C(=O)OC(C(=O)NC2CC2)c2ccccc2)cc1 Show InChI InChI=1S/C21H18F3NO3/c22-21(23,24)16-9-6-14(7-10-16)8-13-18(26)28-19(15-4-2-1-3-5-15)20(27)25-17-11-12-17/h1-10,13,17,19H,11-12H2,(H,25,27)/b13-8+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276399 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCOCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C28H45N6O11P/c1-5-44-13-12-34(16-25(37)32-22(26(30)38)14-17(2)3)28(40)21(10-11-24(29)36)33-27(39)23(31-18(4)35)15-19-6-8-20(9-7-19)45-46(41,42)43/h6-9,17,21-23H,5,10-16H2,1-4H3,(H2,29,36)(H2,30,38)(H,31,35)(H,32,37)(H,33,39)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276400 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CCSCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C28H45N6O10PS/c1-5-46-13-12-34(16-25(37)32-22(26(30)38)14-17(2)3)28(40)21(10-11-24(29)36)33-27(39)23(31-18(4)35)15-19-6-8-20(9-7-19)44-45(41,42)43/h6-9,17,21-23H,5,10-16H2,1-4H3,(H2,29,36)(H2,30,38)(H,31,35)(H,32,37)(H,33,39)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378671 (CHEMBL591237 | NSC-109131) Show SMILES CSc1ncnc2N(CC(=O)[C@H]3CC[C@H]4[C@@H]5CCC6=CC(=O)CC[C@]6(C)[C@H]5CC[C@]34C)CNc12 |r,t:18| Show InChI InChI=1S/C27H36N4O2S/c1-26-10-8-17(32)12-16(26)4-5-18-19-6-7-21(27(19,2)11-9-20(18)26)22(33)13-31-15-30-23-24(31)28-14-29-25(23)34-3/h12,14,18-21,30H,4-11,13,15H2,1-3H3/t18-,19-,20-,21+,26-,27-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378677 (CHEMBL591966) Show SMILES O=C(OCc1cn2ccccc2n1)c1c2CCCc2nc2ccccc12 Show InChI InChI=1S/C21H17N3O2/c25-21(26-13-14-12-24-11-4-3-10-19(24)22-14)20-15-6-1-2-8-17(15)23-18-9-5-7-16(18)20/h1-4,6,8,10-12H,5,7,9,13H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276392 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCCCF)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C28H44FN6O10P/c1-17(2)14-22(26(31)39)33-25(38)16-35(13-5-4-12-29)28(41)21(10-11-24(30)37)34-27(40)23(32-18(3)36)15-19-6-8-20(9-7-19)45-46(42,43)44/h6-9,17,21-23H,4-5,10-16H2,1-3H3,(H2,30,37)(H2,31,39)(H,32,36)(H,33,38)(H,34,40)(H2,42,43,44)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276336 (4-((2S,5S,11S,14S)-2-(N-allylacetamido)-5-(3-amino...) Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)N(CC=C)C(C)=O)C(=O)N[C@@H](CO)C(=O)NCC=C |r| Show InChI InChI=1S/C33H50N7O12P/c1-6-14-35-31(46)26(19-41)39-32(47)25(16-20(3)4)37-29(44)18-36-30(45)24(12-13-28(34)43)38-33(48)27(40(15-7-2)21(5)42)17-22-8-10-23(11-9-22)52-53(49,50)51/h6-11,20,24-27,41H,1-2,12-19H2,3-5H3,(H2,34,43)(H,35,46)(H,36,45)(H,37,44)(H,38,48)(H,39,47)(H2,49,50,51)/t24-,25-,26-,27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276403 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC(C)C[C@H](NC(=O)CN(CCCCC#N)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(N)=O |r| Show InChI InChI=1S/C29H44N7O10P/c1-18(2)15-23(27(32)40)34-26(39)17-36(14-6-4-5-13-30)29(42)22(11-12-25(31)38)35-28(41)24(33-19(3)37)16-20-7-9-21(10-8-20)46-47(43,44)45/h7-10,18,22-24H,4-6,11-12,14-17H2,1-3H3,(H2,31,38)(H2,32,40)(H,33,37)(H,34,39)(H,35,41)(H2,43,44,45)/t22-,23-,24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378678 (CHEMBL590542) Show SMILES CCOC(=O)c1sc(nc1C)N1C(c2c(oc3ccc(F)cc3c2=O)C1=O)c1ccc(C)cc1 Show InChI InChI=1S/C25H19FN2O5S/c1-4-32-24(31)22-13(3)27-25(34-22)28-19(14-7-5-12(2)6-8-14)18-20(29)16-11-15(26)9-10-17(16)33-21(18)23(28)30/h5-11,19H,4H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378679 (CHEMBL590803) Show SMILES COC(=O)c1ccc(COc2ccc(cc2OC)C2Nc3ccccc3C(=O)N2C2CC2)cc1 Show InChI InChI=1S/C27H26N2O5/c1-32-24-15-19(11-14-23(24)34-16-17-7-9-18(10-8-17)27(31)33-2)25-28-22-6-4-3-5-21(22)26(30)29(25)20-12-13-20/h3-11,14-15,20,25,28H,12-13,16H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378676 (CHEMBL591965) Show SMILES FC(F)(F)c1ccc(\C=C\C(=O)OC(C(=O)NC2CC2)c2ccccc2)cc1 Show InChI InChI=1S/C21H18F3NO3/c22-21(23,24)16-9-6-14(7-10-16)8-13-18(26)28-19(15-4-2-1-3-5-15)20(27)25-17-11-12-17/h1-10,13,17,19H,11-12H2,(H,25,27)/b13-8+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276342 (4-((2S,5S,11S)-2-acetamido-7-allyl-5-(3-amino-3-ox...) Show SMILES CC(C)C[C@H](NC(=O)CN(CC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCC=C |r| Show InChI InChI=1S/C30H45N6O10P/c1-6-14-32-28(40)24(16-19(3)4)34-27(39)18-36(15-7-2)30(42)23(12-13-26(31)38)35-29(41)25(33-20(5)37)17-21-8-10-22(11-9-21)46-47(43,44)45/h6-11,19,23-25H,1-2,12-18H2,3-5H3,(H2,31,38)(H,32,40)(H,33,37)(H,34,39)(H,35,41)(H2,43,44,45)/t23-,24-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276335 (4-((2S,5S,11S,14S)-2-acetamido-7-allyl-5-(3-amino-...) Show SMILES CC(C)C[C@H](NC(=O)CN(CC=C)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)NCC=C |r| Show InChI InChI=1S/C33H50N7O12P/c1-6-14-35-30(45)27(19-41)39-31(46)25(16-20(3)4)37-29(44)18-40(15-7-2)33(48)24(12-13-28(34)43)38-32(47)26(36-21(5)42)17-22-8-10-23(11-9-22)52-53(49,50)51/h6-11,20,24-27,41H,1-2,12-19H2,3-5H3,(H2,34,43)(H,35,45)(H,36,42)(H,37,44)(H,38,47)(H,39,46)(H2,49,50,51)/t24-,25-,26-,27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378677 (CHEMBL591966) Show SMILES O=C(OCc1cn2ccccc2n1)c1c2CCCc2nc2ccccc12 Show InChI InChI=1S/C21H17N3O2/c25-21(26-13-14-12-24-11-4-3-10-19(24)22-14)20-15-6-1-2-8-17(15)23-18-9-5-7-16(18)20/h1-4,6,8,10-12H,5,7,9,13H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378678 (CHEMBL590542) Show SMILES CCOC(=O)c1sc(nc1C)N1C(c2c(oc3ccc(F)cc3c2=O)C1=O)c1ccc(C)cc1 Show InChI InChI=1S/C25H19FN2O5S/c1-4-32-24(31)22-13(3)27-25(34-22)28-19(14-7-5-12(2)6-8-14)18-20(29)16-11-15(26)9-10-17(16)33-21(18)23(28)30/h5-11,19H,4H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276394 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES COCCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C27H43N6O11P/c1-16(2)13-21(25(29)37)31-24(36)15-33(11-12-43-4)27(39)20(9-10-23(28)35)32-26(38)22(30-17(3)34)14-18-5-7-19(8-6-18)44-45(40,41)42/h5-8,16,20-22H,9-15H2,1-4H3,(H2,28,35)(H2,29,37)(H,30,34)(H,31,36)(H,32,38)(H2,40,41,42)/t20-,21-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378680 (CHEMBL590804) Show SMILES COc1cc(\C=C\C(=O)OC(C(=O)N2CCCCC2)c2ccccc2)ccc1O Show InChI InChI=1S/C23H25NO5/c1-28-20-16-17(10-12-19(20)25)11-13-21(26)29-22(18-8-4-2-5-9-18)23(27)24-14-6-3-7-15-24/h2,4-5,8-13,16,22,25H,3,6-7,14-15H2,1H3/b13-11+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378680 (CHEMBL590804) Show SMILES COc1cc(\C=C\C(=O)OC(C(=O)N2CCCCC2)c2ccccc2)ccc1O Show InChI InChI=1S/C23H25NO5/c1-28-20-16-17(10-12-19(20)25)11-13-21(26)29-22(18-8-4-2-5-9-18)23(27)24-14-6-3-7-15-24/h2,4-5,8-13,16,22,25H,3,6-7,14-15H2,1H3/b13-11+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.01% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378681 (CHEMBL600867) Show SMILES Cc1cc(C)nc(N=CC(C#N)C(=O)c2cccc(CSc3ccccc3)c2)n1 |w:8.8| Show InChI InChI=1S/C23H20N4OS/c1-16-11-17(2)27-23(26-16)25-14-20(13-24)22(28)19-8-6-7-18(12-19)15-29-21-9-4-3-5-10-21/h3-12,14,20H,15H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276341 (4-((2S,5S,11S)-2-acetamido-10-allyl-5-(3-amino-3-o...) Show SMILES CC(C)C[C@H](N(CC=C)C(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCC=C |r| Show InChI InChI=1S/C30H45N6O10P/c1-6-14-32-30(42)25(16-19(3)4)36(15-7-2)27(39)18-33-28(40)23(12-13-26(31)38)35-29(41)24(34-20(5)37)17-21-8-10-22(11-9-21)46-47(43,44)45/h6-11,19,23-25H,1-2,12-18H2,3-5H3,(H2,31,38)(H,32,42)(H,33,40)(H,34,37)(H,35,41)(H2,43,44,45)/t23-,24-,25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276390 (4-((S)-2-acetamido-3-((S)-5-amino-1-((2-((S)-1-ami...) Show SMILES CC#CCN(CC(=O)N[C@@H](CC(C)C)C(N)=O)C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O |r| Show InChI InChI=1S/C28H41N6O10P/c1-5-6-13-34(16-25(37)32-22(26(30)38)14-17(2)3)28(40)21(11-12-24(29)36)33-27(39)23(31-18(4)35)15-19-7-9-20(10-8-19)44-45(41,42)43/h7-10,17,21-23H,11-16H2,1-4H3,(H2,29,36)(H2,30,38)(H,31,35)(H,32,37)(H,33,39)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276344 (4-((2S,5S,11S)-2-acetamido-5-(3-amino-3-oxopropyl)...) Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCCC=C |r| Show InChI InChI=1S/C28H43N6O10P/c1-5-6-13-30-27(39)22(14-17(2)3)33-25(37)16-31-26(38)21(11-12-24(29)36)34-28(40)23(32-18(4)35)15-19-7-9-20(10-8-19)44-45(41,42)43/h5,7-10,17,21-23H,1,6,11-16H2,2-4H3,(H2,29,36)(H,30,39)(H,31,38)(H,32,35)(H,33,37)(H,34,40)(H2,41,42,43)/t21-,22-,23-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276345 (4-((2S,5S,11S)-2-acetamido-5-(3-amino-3-oxopropyl)...) Show SMILES CC(C)C[C@H](N(CCC=C)C(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCCC=C |r| Show InChI InChI=1S/C32H49N6O10P/c1-6-8-16-34-32(44)27(18-21(3)4)38(17-9-7-2)29(41)20-35-30(42)25(14-15-28(33)40)37-31(43)26(36-22(5)39)19-23-10-12-24(13-11-23)48-49(45,46)47/h6-7,10-13,21,25-27H,1-2,8-9,14-20H2,3-5H3,(H2,33,40)(H,34,44)(H,35,42)(H,36,39)(H,37,43)(H2,45,46,47)/t25-,26-,27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276338 (4-((2S,5S,11S,14S)-2-acetamido-5-(3-amino-3-oxopro...) Show SMILES CC(C)C[C@H](N(CCC=C)C(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)N[C@@H](CO)C(=O)NCCC=C |r| Show InChI InChI=1S/C35H54N7O12P/c1-6-8-16-37-33(48)28(21-43)41-35(50)29(18-22(3)4)42(17-9-7-2)31(46)20-38-32(47)26(14-15-30(36)45)40-34(49)27(39-23(5)44)19-24-10-12-25(13-11-24)54-55(51,52)53/h6-7,10-13,22,26-29,43H,1-2,8-9,14-21H2,3-5H3,(H2,36,45)(H,37,48)(H,38,47)(H,39,44)(H,40,49)(H,41,50)(H2,51,52,53)/t26-,27-,28-,29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50378679 (CHEMBL590803) Show SMILES COC(=O)c1ccc(COc2ccc(cc2OC)C2Nc3ccccc3C(=O)N2C2CC2)cc1 Show InChI InChI=1S/C27H26N2O5/c1-32-24-15-19(11-14-23(24)34-16-17-7-9-18(10-8-17)27(31)33-2)25-28-22-6-4-3-5-21(22)26(30)29(25)20-12-13-20/h3-11,14-15,20,25,28H,12-13,16H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Inhibition of human tyrosyl-DNA phosphodiesterase 1 after 30 mins by alpha high throughput screening assay in presence of 0.05% Tween-20				Bioorg Med Chem 18: 182-9 (2010) Article DOI: 10.1016/j.bmc.2009.11.008 BindingDB Entry DOI: 10.7270/Q2ZS2XGF
					More data for this Ligand-Target Pair
SHC-transforming protein 1 (Homo sapiens (Human))	BDBM50276340 (4-((2S,5S,11S)-2-acetamido-5-(3-amino-3-oxopropyl)...) Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(C)=O)C(=O)NCC=C |r| Show InChI InChI=1S/C27H41N6O10P/c1-5-12-29-26(38)21(13-16(2)3)32-24(36)15-30-25(37)20(10-11-23(28)35)33-27(39)22(31-17(4)34)14-18-6-8-19(9-7-18)43-44(40,41)42/h5-9,16,20-22H,1,10-15H2,2-4H3,(H2,28,35)(H,29,38)(H,30,37)(H,31,34)(H,32,36)(H,33,39)(H2,40,41,42)/t20-,21-,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of FITC-tagged NH-(CH2)4-CO-phospho-tyrosine-glutamine-glycine-leucine-serine-amide from Shc Src homology 2 domain (unknown origin) by f...				J Med Chem 52: 1612-8 (2009) Article DOI: 10.1021/jm800789h BindingDB Entry DOI: 10.7270/Q2XP74TZ
					More data for this Ligand-Target Pair

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