Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with all data for entry = 50041064   

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
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50123591 ((7-Chloro-quinolin-4-yl)-{3-[4-(3-diisobutylamino-...) Show SMILES CC(C)CN(CCCN1CCN(CCCNc2ccnc3cc(Cl)ccc23)CC1)CC(C)C Show InChI InChI=1S/C27H44ClN5/c1-22(2)20-33(21-23(3)4)14-6-13-32-17-15-31(16-18-32)12-5-10-29-26-9-11-30-27-19-24(28)7-8-25(26)27/h7-9,11,19,22-23H,5-6,10,12-18,20-21H2,1-4H3,(H,29,30)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134482 (CHEMBL331745 | {3-[4-(3-Diisobutylamino-propyl)-pi...) Show SMILES CC(C)CN(CCCN1CCN(CCCNc2ccnc3ccccc23)CC1)CC(C)C Show InChI InChI=1S/C27H45N5/c1-23(2)21-32(22-24(3)4)16-8-15-31-19-17-30(18-20-31)14-7-12-28-27-11-13-29-26-10-6-5-9-25(26)27/h5-6,9-11,13,23-24H,7-8,12,14-22H2,1-4H3,(H,28,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134471 ((1H-Benzoimidazol-2-yl)-{3-[4-(3-diisobutylamino-p...) Show SMILES CC(C)CN(CCCN1CCN(CCCNc2nc3ccccc3[nH]2)CC1)CC(C)C Show InChI InChI=1S/C25H44N6/c1-21(2)19-31(20-22(3)4)14-8-13-30-17-15-29(16-18-30)12-7-11-26-25-27-23-9-5-6-10-24(23)28-25/h5-6,9-10,21-22H,7-8,11-20H2,1-4H3,(H2,26,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	PubMed	n/a	n/a	6.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM22985 (Aralen | CHEMBL76 | CHLOROQUINE PHOSPHATE | Chloro...) Show SMILES CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12 Show InChI InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	7.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134477 ((3-{4-[3-(4-Chloro-benzylamino)-propyl]-piperazin-...) Show SMILES CC(C)CN(CCCN1CCN(CCCNCc2ccc(Cl)cc2)CC1)CC(C)C Show InChI InChI=1S/C25H45ClN4/c1-22(2)20-30(21-23(3)4)14-6-13-29-17-15-28(16-18-29)12-5-11-27-19-24-7-9-25(26)10-8-24/h7-10,22-23,27H,5-6,11-21H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	9.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134470 (CHEMBL125382 | Diisobutyl-(3-{4-[3-(4-methoxy-benz...) Show SMILES COc1ccc(CNCCCN2CCN(CCCN(CC(C)C)CC(C)C)CC2)cc1 Show InChI InChI=1S/C26H48N4O/c1-23(2)21-30(22-24(3)4)15-7-14-29-18-16-28(17-19-29)13-6-12-27-20-25-8-10-26(31-5)11-9-25/h8-11,23-24,27H,6-7,12-22H2,1-5H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134484 (CHEMBL122346 | N-{3-[4-(3-Diisobutylamino-propyl)-...) Show SMILES COc1ccc(cc1)C(=O)NCCCN1CCN(CCCN(CC(C)C)CC(C)C)CC1 Show InChI InChI=1S/C26H46N4O2/c1-22(2)20-30(21-23(3)4)15-7-14-29-18-16-28(17-19-29)13-6-12-27-26(31)24-8-10-25(32-5)11-9-24/h8-11,22-23H,6-7,12-21H2,1-5H3,(H,27,31)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134475 (Benzooxazol-2-yl-{3-[4-(3-diisobutylamino-propyl)-...) Show SMILES CC(C)CN(CCCN1CCN(CCCNc2nc3ccccc3o2)CC1)CC(C)C Show InChI InChI=1S/C25H43N5O/c1-21(2)19-30(20-22(3)4)14-8-13-29-17-15-28(16-18-29)12-7-11-26-25-27-23-9-5-6-10-24(23)31-25/h5-6,9-10,21-22H,7-8,11-20H2,1-4H3,(H,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134472 (CHEMBL419060 | Diisobutyl-[3-(4-{3-[(pyridin-4-ylm...) Show SMILES CC(C)CN(CCCN1CCN(CCCNCc2ccncc2)CC1)CC(C)C Show InChI InChI=1S/C24H45N5/c1-22(2)20-29(21-23(3)4)14-6-13-28-17-15-27(16-18-28)12-5-9-26-19-24-7-10-25-11-8-24/h7-8,10-11,22-23,26H,5-6,9,12-21H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50134478 (CHEMBL122117 | {3-[4-(3-Diisobutylamino-propyl)-pi...) Show SMILES CC(C)CN(CCCN1CCN(CCCNc2cnccn2)CC1)CC(C)C Show InChI InChI=1S/C22H42N6/c1-20(2)18-28(19-21(3)4)12-6-11-27-15-13-26(14-16-27)10-5-7-24-22-17-23-8-9-25-22/h8-9,17,20-21H,5-7,10-16,18-19H2,1-4H3,(H,24,25)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille II Curated by ChEMBL					Assay Description Inhibition of 1-monooleoyl glycerol (MOG) induced beta-hematin formation				Bioorg Med Chem Lett 13: 3783-7 (2003) BindingDB Entry DOI: 10.7270/Q2DV1M2P
					More data for this Ligand-Target Pair