Compile Data Set for Download or QSAR

Found 34 hits Enz. Inhib. hit(s) with all data for entry = 50043141   

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
Acrosin (Homo sapiens (Human))	BDBM50436621 (CHEMBL2397955) Show SMILES CC(O)CN(CC(C)O)C(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C16H21N3O3/c1-11(20)9-19(10-12(2)21)16(22)15-8-14(17-18-15)13-6-4-3-5-7-13/h3-8,11-12,20-21H,9-10H2,1-2H3,(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL 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
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436591 (CHEMBL2397954) Show SMILES CC(O)CNC(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C13H15N3O2/c1-9(17)8-14-13(18)12-7-11(15-16-12)10-5-3-2-4-6-10/h2-7,9,17H,8H2,1H3,(H,14,18)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436618 (CHEMBL2397958) Show SMILES COc1ccc(cc1)-c1cc([nH]n1)C(=O)NCCO Show InChI InChI=1S/C13H15N3O3/c1-19-10-4-2-9(3-5-10)11-8-12(16-15-11)13(18)14-6-7-17/h2-5,8,17H,6-7H2,1H3,(H,14,18)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436597 (CHEMBL2397948) Show SMILES CC(O)CNC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C13H14BrN3O2/c1-8(18)7-15-13(19)12-6-11(16-17-12)9-2-4-10(14)5-3-9/h2-6,8,18H,7H2,1H3,(H,15,19)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436598 (CHEMBL2397947) Show SMILES OCCCNC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C13H14BrN3O2/c14-10-4-2-9(3-5-10)11-8-12(17-16-11)13(19)15-6-1-7-18/h2-5,8,18H,1,6-7H2,(H,15,19)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50382109 (CHEMBL2023319) Show SMILES Clc1ccc(-c2cc(C=O)no2)c(Cl)c1 Show InChI InChI=1S/C10H5Cl2NO2/c11-6-1-2-8(9(12)3-6)10-4-7(5-14)13-15-10/h1-5H	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50424449 (CHEMBL2316083) Show SMILES COc1ccc(cc1)-c1cc([nH]n1)C(=O)N(C)CCO Show InChI InChI=1S/C14H17N3O3/c1-17(7-8-18)14(19)13-9-12(15-16-13)10-3-5-11(20-2)6-4-10/h3-6,9,18H,7-8H2,1-2H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436600 (CHEMBL2397945) Show SMILES OCCNC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C12H12BrN3O2/c13-9-3-1-8(2-4-9)10-7-11(16-15-10)12(18)14-5-6-17/h1-4,7,17H,5-6H2,(H,14,18)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436592 (CHEMBL2397953) Show SMILES OCCCNC(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C13H15N3O2/c17-8-4-7-14-13(18)12-9-11(15-16-12)10-5-2-1-3-6-10/h1-3,5-6,9,17H,4,7-8H2,(H,14,18)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436607 (CHEMBL2397938) Show SMILES OCCNC(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C12H12N4O4/c17-5-4-13-12(18)11-7-10(14-15-11)8-2-1-3-9(6-8)16(19)20/h1-3,6-7,17H,4-5H2,(H,13,18)(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436601 (CHEMBL2397944) Show SMILES OCC(CO)(CO)NC(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O6/c19-6-14(7-20,8-21)15-13(22)12-5-11(16-17-12)9-2-1-3-10(4-9)18(23)24/h1-5,19-21H,6-8H2,(H,15,22)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436605 (CHEMBL2397940) Show SMILES OCCCNC(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c18-6-2-5-14-13(19)12-8-11(15-16-12)9-3-1-4-10(7-9)17(20)21/h1,3-4,7-8,18H,2,5-6H2,(H,14,19)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436603 (CHEMBL2397942) Show SMILES CN(CCO)C(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c1-16(5-6-18)13(19)12-8-11(14-15-12)9-3-2-4-10(7-9)17(20)21/h2-4,7-8,18H,5-6H2,1H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436596 (CHEMBL2397949) Show SMILES CC(CO)NC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C13H14BrN3O2/c1-8(7-18)15-13(19)12-6-11(16-17-12)9-2-4-10(14)5-3-9/h2-6,8,18H,7H2,1H3,(H,15,19)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436619 (CHEMBL2397957) Show SMILES OCC(CO)(CO)NC(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C14H17N3O4/c18-7-14(8-19,9-20)15-13(21)12-6-11(16-17-12)10-4-2-1-3-5-10/h1-6,18-20H,7-9H2,(H,15,21)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436612 (CHEMBL2397933) Show SMILES CC(O)CN(CC(C)O)C(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C16H20N4O5/c1-10(21)8-19(9-11(2)22)16(23)15-7-14(17-18-15)12-3-5-13(6-4-12)20(24)25/h3-7,10-11,21-22H,8-9H2,1-2H3,(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.21E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436599 (CHEMBL2397946) Show SMILES OCCN(CCO)C(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C14H16BrN3O3/c15-11-3-1-10(2-4-11)12-9-13(17-16-12)14(21)18(5-7-19)6-8-20/h1-4,9,19-20H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.52E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436593 (CHEMBL2397952) Show SMILES OCCN(CCO)C(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C14H17N3O3/c18-8-6-17(7-9-19)14(20)13-10-12(15-16-13)11-4-2-1-3-5-11/h1-5,10,18-19H,6-9H2,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436604 (CHEMBL2397941) Show SMILES CC(O)CNC(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c1-8(18)7-14-13(19)12-6-11(15-16-12)9-3-2-4-10(5-9)17(20)21/h2-6,8,18H,7H2,1H3,(H,14,19)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.83E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436610 (CHEMBL2397935) Show SMILES CC(C)(CO)NC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O4/c1-14(2,8-19)15-13(20)12-7-11(16-17-12)9-3-5-10(6-4-9)18(21)22/h3-7,19H,8H2,1-2H3,(H,15,20)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.88E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436611 (CHEMBL2397934) Show SMILES CN(CCO)C(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c1-16(6-7-18)13(19)12-8-11(14-15-12)9-2-4-10(5-3-9)17(20)21/h2-5,8,18H,6-7H2,1H3,(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436609 (CHEMBL2397936) Show SMILES OCCOCCNC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O5/c19-6-8-23-7-5-15-14(20)13-9-12(16-17-13)10-1-3-11(4-2-10)18(21)22/h1-4,9,19H,5-8H2,(H,15,20)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.07E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436606 (CHEMBL2397939) Show SMILES OCCN(CCO)C(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O5/c19-6-4-17(5-7-20)14(21)13-9-12(15-16-13)10-2-1-3-11(8-10)18(22)23/h1-3,8-9,19-20H,4-7H2,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436616 (CHEMBL2397929) Show SMILES OCCNC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C12H12N4O4/c17-6-5-13-12(18)11-7-10(14-15-11)8-1-3-9(4-2-8)16(19)20/h1-4,7,17H,5-6H2,(H,13,18)(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436594 (CHEMBL2397951) Show SMILES OCCNC(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C12H13N3O2/c16-7-6-13-12(17)11-8-10(14-15-11)9-4-2-1-3-5-9/h1-5,8,16H,6-7H2,(H,13,17)(H,14,15)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436613 (CHEMBL2397932) Show SMILES CC(O)CNC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c1-8(18)7-14-13(19)12-6-11(15-16-12)9-2-4-10(5-3-9)17(20)21/h2-6,8,18H,7H2,1H3,(H,14,19)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.95E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436620 (CHEMBL2397956) Show SMILES CC(CO)NC(=O)c1cc(n[nH]1)-c1ccccc1 Show InChI InChI=1S/C13H15N3O2/c1-9(8-17)14-13(18)12-7-11(15-16-12)10-5-3-2-4-6-10/h2-7,9,17H,8H2,1H3,(H,14,18)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436614 (CHEMBL2397931) Show SMILES OCCCNC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C13H14N4O4/c18-7-1-6-14-13(19)12-8-11(15-16-12)9-2-4-10(5-3-9)17(20)21/h2-5,8,18H,1,6-7H2,(H,14,19)(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.07E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436608 (CHEMBL2397937) Show SMILES OCC(CO)(CO)NC(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O6/c19-6-14(7-20,8-21)15-13(22)12-5-11(16-17-12)9-1-3-10(4-2-9)18(23)24/h1-5,19-21H,6-8H2,(H,15,22)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.22E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436615 (CHEMBL2397930) Show SMILES OCCN(CCO)C(=O)c1cc(n[nH]1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O5/c19-7-5-17(6-8-20)14(21)13-9-12(15-16-13)10-1-3-11(4-2-10)18(22)23/h1-4,9,19-20H,5-8H2,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436617 (CHEMBL2397928) Show SMILES COc1ccc(cc1)-c1cc([nH]n1)C(=O)NCCOCCO Show InChI InChI=1S/C15H19N3O4/c1-21-12-4-2-11(3-5-12)13-10-14(18-17-13)15(20)16-6-8-22-9-7-19/h2-5,10,19H,6-9H2,1H3,(H,16,20)(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.02E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436602 (CHEMBL2397943) Show SMILES OCCOCCNC(=O)c1cc(n[nH]1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H16N4O5/c19-5-7-23-6-4-15-14(20)13-9-12(16-17-13)10-2-1-3-11(8-10)18(21)22/h1-3,8-9,19H,4-7H2,(H,15,20)(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+6	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50436595 (CHEMBL2397950) Show SMILES OCCOCCNC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1 Show InChI InChI=1S/C14H16BrN3O3/c15-11-3-1-10(2-4-11)12-9-13(18-17-12)14(20)16-5-7-21-8-6-19/h1-4,9,19H,5-8H2,(H,16,20)(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair
Acrosin (Homo sapiens (Human))	BDBM50354886 (CHEMBL466465) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CCCCN)C(=O)CCl |r| Show InChI InChI=1S/C14H21ClN2O3S/c1-11-5-7-12(8-6-11)21(19,20)17-13(14(18)10-15)4-2-3-9-16/h5-8,13,17H,2-4,9-10,16H2,1H3/t13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.43E+8	n/a	n/a	n/a	n/a	n/a	n/a
Second Military Medical University Curated by ChEMBL					Assay Description Inhibition of human sperm acrosin using BAPNA as substrate after 3 hrs by spectrophotometric analysis				Bioorg Med Chem Lett 23: 4177-84 (2013) Article DOI: 10.1016/j.bmcl.2013.05.031 BindingDB Entry DOI: 10.7270/Q25Q4XHT
					More data for this Ligand-Target Pair