Compile Data Set for Download or QSAR

Found 8 hits with Last Name = 'jalalpure' and Initial = 'ss'   

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
DNA topoisomerase 2-alpha (Homo sapiens (Human))	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	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570427 (CHEMBL4864715) Show SMILES NC1=C(C#N)C(c2cc3ccccc3s2)c2c(O1)c1ccccc1oc2=O |c:1| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570429 (CHEMBL4878037) Show SMILES NC1=C(C#N)C(c2c[nH]c3ccccc23)c2c(O1)c1ccccc1oc2=O |c:1| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570428 (CHEMBL4870551) Show SMILES NC1=C(C#N)C(c2cnc3ccccc3c2)c2c(O1)c1ccccc1oc2=O |c:1| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570432 (CHEMBL4849502) Show SMILES Cc1cc2occ(-c3nc(c(-c4ccccc4)n3-c3ccc(Br)cc3)-c3ccccc3)c(=O)c2cc1Cl Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570430 (CHEMBL4855587) Show SMILES NC1=C(C#N)C(c2cc(=O)c3ccccc3o2)c2c(O1)c1ccccc1oc2=O |c:1| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.64E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570431 (CHEMBL4869150) Show SMILES Cc1cc2occ(-c3nc(c(-c4ccccc4)n3-c3ccc(Cl)c(Cl)c3)-c3ccccc3)c(=O)c2cc1Cl Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair
DNA topoisomerase 2-alpha (Homo sapiens (Human))	BDBM50570433 (CHEMBL4853443) Show SMILES Cc1cc2occ(-c3nc(c(-c4ccccc4)n3-c3ccc(cc3)[N+]([O-])=O)-c3ccccc3)c(=O)c2cc1Cl Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human topoisomerase-2 alpha in human A498 cells assessed as decrease in relaxation of supercoiled DNA at 10 uM				Citation and Details Article DOI: 10.1016/j.bmcl.2021.127916 BindingDB Entry DOI: 10.7270/Q2VQ36GH
					More data for this Ligand-Target Pair