Compile Data Set for Download or QSAR

Found 7 hits Enz. Inhib. hit(s) with all data for entry = 50041592   

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)	BDBM50412201 (CRYPTOLEPINE HYDROCHLORIDE | Cryptolepine) Show SMILES Cn1c2c(cc3ccccc13)nc1ccccc21 Show InChI InChI=1S/C16H12N2/c1-18-15-9-5-2-6-11(15)10-14-16(18)12-7-3-4-8-13(12)17-14/h2-10H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.72E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					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	Article PubMed	n/a	n/a	2.56E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50412205 (CHEMBL512770) Show SMILES C[n+]1cc2[nH]c3ccccc3c2c2ccccc12 Show InChI InChI=1S/C16H12N2/c1-18-10-14-16(12-7-3-5-9-15(12)18)11-6-2-4-8-13(11)17-14/h2-10H,1H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.24E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50412204 (CHEMBL465591) Show SMILES Cn1c2nc3ccccc3c2cc2ccccc12 Show InChI InChI=1S/C16H12N2/c1-18-15-9-5-2-6-11(15)10-13-12-7-3-4-8-14(12)17-16(13)18/h2-10H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.97E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50367247 (QUININE | Quinamm | Quinsan | cid_3034034) Show SMILES COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 |THB:20:19:12.13:16.15,10:12:19.18:16.15| Show InChI InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	7.40E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50412203 (CHEMBL502768) Show SMILES Cn1cc2c3ccccc3nc2c2ccccc12 Show InChI InChI=1S/C16H12N2/c1-18-10-13-11-6-2-4-8-14(11)17-16(13)12-7-3-5-9-15(12)18/h2-10H,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.59E+9	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (Plasmodium falciparum)	BDBM50412202 (CHEMBL463913) Show SMILES Cn1c2ccccc2c2c[n+](C)c3ccccc3c12 Show InChI InChI=1S/C17H15N2/c1-18-11-14-12-7-3-6-10-16(12)19(2)17(14)13-8-4-5-9-15(13)18/h3-11H,1-2H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.30E+10	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of beta-hematin formation by BHIA assay				J Nat Prod 68: 674-7 (2005) Article DOI: 10.1021/np0496284 BindingDB Entry DOI: 10.7270/Q2S46T5K
					More data for this Ligand-Target Pair