Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Deoxyribonuclease-2-alpha'   

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
Deoxyribonuclease-2-alpha (Homo sapiens (Human))	BDBM50326048 ((2R,5S,8S,11S,14S,17S,20S,23S,26S,29S,32S,35R)-8,1...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(O)=O |r,wU:98.103,51.50,8.8,15.14,76.78,34.33,wD:4.4,65.66,26.25,84.86,103.107,42.41,(.31,-40.62,;.28,-39.08,;1.6,-38.28,;-1.07,-38.34,;-1.09,-36.79,;-2.44,-36.06,;-3.77,-36.84,;-3.74,-38.38,;-5.12,-36.1,;-6.42,-36.89,;-5.16,-34.55,;-3.84,-33.76,;.22,-36,;.19,-34.46,;1.57,-36.74,;2.88,-35.94,;2.85,-34.4,;4.18,-33.6,;4.14,-32.07,;5.46,-31.27,;5.43,-29.73,;4.07,-28.99,;6.76,-28.94,;4.24,-36.68,;4.27,-38.22,;5.56,-35.89,;6.91,-36.63,;6.94,-38.17,;8.29,-38.91,;8.32,-40.45,;9.61,-38.12,;8.23,-35.84,;8.2,-34.29,;9.58,-36.58,;10.9,-35.78,;10.86,-34.24,;12.18,-33.45,;12.15,-31.91,;13.53,-34.19,;12.24,-36.52,;12.27,-38.06,;13.56,-35.73,;14.91,-36.47,;14.94,-38.01,;16.28,-38.75,;16.32,-40.29,;15,-41.08,;17.66,-41.04,;16.22,-35.67,;16.19,-34.14,;17.57,-36.42,;18.89,-35.62,;18.86,-34.08,;20.18,-33.29,;21.45,-34.16,;22.67,-33.23,;22.16,-31.78,;22.89,-30.42,;22.09,-29.1,;20.55,-29.15,;19.82,-30.5,;20.62,-31.81,;20.24,-36.36,;20.28,-37.9,;21.56,-35.56,;22.91,-36.3,;22.94,-37.84,;24.29,-38.58,;25.61,-37.79,;26.96,-38.53,;26.99,-40.07,;25.67,-40.87,;24.33,-40.12,;24.23,-35.51,;24.19,-33.97,;25.58,-36.24,;26.9,-35.46,;26.87,-33.91,;28.19,-33.12,;28.16,-31.58,;29.53,-33.86,;28.25,-36.2,;28.28,-37.73,;29.56,-35.39,;30.91,-36.14,;30.94,-37.68,;32.29,-38.42,;33.53,-37.52,;34.78,-38.42,;34.3,-39.89,;35.06,-41.23,;34.29,-42.56,;32.75,-42.55,;31.98,-41.21,;32.76,-39.89,;32.23,-35.34,;32.2,-33.81,;33.58,-36.08,;34.9,-35.29,;34.87,-33.75,;36.25,-36.03,;36.29,-37.57,;37.57,-35.23,;38.92,-35.97,;38.95,-37.51,;40.3,-38.25,;40.24,-35.18,;41.59,-35.92,;40.21,-33.64,)| Show InChI InChI=1S/C75H110N18O14S2/c1-39(2)28-54(86-64(96)49(76)37-108)68(100)84-52(24-17-27-80-75(78)79)65(97)87-56(30-41(5)6)70(102)88-55(29-40(3)4)69(101)85-53(25-26-62(77)94)66(98)91-60(34-46-36-82-51-23-16-14-21-48(46)51)73(105)90-58(32-44-18-11-10-12-19-44)72(104)89-57(31-42(7)8)71(103)92-59(33-45-35-81-50-22-15-13-20-47(45)50)67(99)83-43(9)63(95)93-61(38-109)74(106)107/h10-16,18-23,35-36,39-43,49,52-61,81-82,108-109H,17,24-34,37-38,76H2,1-9H3,(H2,77,94)(H,83,99)(H,84,100)(H,85,101)(H,86,96)(H,87,97)(H,88,102)(H,89,104)(H,90,105)(H,91,98)(H,92,103)(H,93,95)(H,106,107)(H4,78,79,80)/t43-,49-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Molecular Biology, Medical Research Council Curated by ChEMBL					Assay Description Binding affinity to Dnase 2				Nat Chem Biol 5: 502-7 (2009) Article DOI: 10.1038/nchembio.184 BindingDB Entry DOI: 10.7270/Q2Z60P9P
					More data for this Ligand-Target Pair
Deoxyribonuclease-2-alpha (Sus scrofa)	BDBM22984 ((8S,10S)-10-{[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-me...) Show SMILES COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO |r| Show InChI InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,17-,22+,27-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of porcine spleen DNase 2 assessed as undigested supercoiled pBR322 DNA concentration				J Nat Prod 64: 204-7 (2001) BindingDB Entry DOI: 10.7270/Q2W37W21
					More data for this Ligand-Target Pair
Deoxyribonuclease-2-alpha (Sus scrofa)	BDBM50242374 (CHEMBL505529 | topostatin) Show SMILES CCCCCCCC(C)CC=C(C)C=CC(=O)C(C)CCC1OC(=O)[C@H](CC(OS(O)(=O)=O)C(N)=O)NC(=O)[C@@H](C)CNC(=O)C(=C)NC(=O)C1C |r,w:14.14,10.9| Show InChI InChI=1S/C36H58N4O11S/c1-8-9-10-11-12-13-22(2)14-15-23(3)16-18-29(41)24(4)17-19-30-26(6)34(44)39-27(7)35(45)38-21-25(5)33(43)40-28(36(46)50-30)20-31(32(37)42)51-52(47,48)49/h15-16,18,22,24-26,28,30-31H,7-14,17,19-21H2,1-6H3,(H2,37,42)(H,38,45)(H,39,44)(H,40,43)(H,47,48,49)/t22?,24?,25-,26?,28-,30?,31?/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of porcine spleen DNase 2 assessed as undigested supercoiled pBR322 DNA concentration				J Nat Prod 64: 204-7 (2001) BindingDB Entry DOI: 10.7270/Q2W37W21
					More data for this Ligand-Target Pair
Deoxyribonuclease-2-alpha (Sus scrofa)	BDBM50008923 ((S)-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-...) Show SMILES CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |r| Show InChI InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3/t20-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of porcine spleen DNase 2 assessed as undigested supercoiled pBR322 DNA concentration				J Nat Prod 64: 204-7 (2001) BindingDB Entry DOI: 10.7270/Q2W37W21
					More data for this Ligand-Target Pair
Deoxyribonuclease-2-alpha (Sus scrofa)	BDBM50164888 (6-Hydroxy-3-[1-(4-hydroxy-phenyl)-meth-(E)-ylidene...) Show SMILES Oc1ccc(\C=C2\C(=O)Oc3cc(O)ccc23)cc1 Show InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)7-13-12-6-5-11(17)8-14(12)19-15(13)18/h1-8,16-17H/b13-7+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of porcine spleen DNase 2 assessed as undigested supercoiled pBR322 DNA concentration				J Nat Prod 64: 204-7 (2001) BindingDB Entry DOI: 10.7270/Q2W37W21
					More data for this Ligand-Target Pair