BindingDB PrimarySearch

Found 21 hits with Last Name = 'ali' and Initial = 'ms'
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM8726 (5-chloro-2-(2,4-dichlorophenoxy)phenol \| CHEMBL849...) Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl Show InChI	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
University of Yaounde Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum Enoyl-ACP reductase using crotonyl-CoA as substrate peincubated for 5 mins measured after 10 mins of substrate ad...				J Nat Prod 74: 1370-8 (2011) Article DOI: 10.1021/np100896w BindingDB Entry DOI: 10.7270/Q2WH2QC7
University of Yaounde Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93134 (PDE5 Inhibitor, 5 \| PDE5 Inhibitor, 8) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93134 (PDE5 Inhibitor, 5 \| PDE5 Inhibitor, 8) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93140 (PDE5 Inhibitor, 12) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93141 (PDE5 Inhibitor, 19) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93136 (PDE5 Inhibitor, 6) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
Transmembrane protease serine 2 (Homo sapiens (Human))	BDBM50239965 (Bromhexine \| CHEBI:77032) Show SMILES CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1 Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center					Assay Description To identify inhibitors of TMPRSS2 that may be used directly in clinical studies or as lead compounds to develop targeted drugs, we screened several c...				Cancer Discov 4: 1310-25 (2014) Article DOI: 10.1158/2159-8290.CD-13-1010 BindingDB Entry DOI: 10.7270/Q2HD7Z13
Fred Hutchinson Cancer Research Center					More data for this Ligand-Target Pair
Transmembrane protease serine 2 (Homo sapiens (Human))	BDBM420291 (0591-5329 \| 4-(Methoxycarbonyl)phenyl thiophene-2-...) Show SMILES COC(=O)c1ccc(OC(=O)c2cccs2)cc1 Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase UniChem	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center					Assay Description To identify inhibitors of TMPRSS2 that may be used directly in clinical studies or as lead compounds to develop targeted drugs, we screened several c...				Cancer Discov 4: 1310-25 (2014) Article DOI: 10.1158/2159-8290.CD-13-1010 BindingDB Entry DOI: 10.7270/Q2HD7Z13
Fred Hutchinson Cancer Research Center					More data for this Ligand-Target Pair
Transmembrane protease serine 2 (Homo sapiens (Human))	BDBM50022172 ((7-Hydroxy-2-oxo-2H-chromen-4-yl)-acetic acid meth...) Show SMILES COC(=O)Cc1cc(=O)oc2cc(O)ccc12 Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center					Assay Description To identify inhibitors of TMPRSS2 that may be used directly in clinical studies or as lead compounds to develop targeted drugs, we screened several c...				Cancer Discov 4: 1310-25 (2014) Article DOI: 10.1158/2159-8290.CD-13-1010 BindingDB Entry DOI: 10.7270/Q2HD7Z13
Fred Hutchinson Cancer Research Center					More data for this Ligand-Target Pair
Tubulin beta chain (Sus scrofa)	BDBM50005480 ((-)-combretastatin \| (Z)-3'-hydroxy-3,4,4',5-tetra...) Show SMILES COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1O Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of porcine brain tubulin polymerization measured at 1 min interval for 1 hr by fluorescence plate reader assay				Bioorg Med Chem Lett 26: 4527-4535 (2016) Article DOI: 10.1016/j.bmcl.2016.06.044 BindingDB Entry DOI: 10.7270/Q2RF5ZJK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Tubulin beta chain (Sus scrofa)	BDBM50536788 (CHEMBL4537424) Show SMILES Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of porcine brain tubulin polymerization measured at 1 min interval for 1 hr by fluorescence plate reader assay				Bioorg Med Chem Lett 26: 4527-4535 (2016) Article DOI: 10.1016/j.bmcl.2016.06.044 BindingDB Entry DOI: 10.7270/Q2RF5ZJK
					More data for this Ligand-Target Pair
Tubulin beta chain (Sus scrofa)	BDBM50536789 (CHEMBL4549647) Show SMILES Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of porcine brain tubulin polymerization measured at 1 min interval for 1 hr by fluorescence plate reader assay				Bioorg Med Chem Lett 26: 4527-4535 (2016) Article DOI: 10.1016/j.bmcl.2016.06.044 BindingDB Entry DOI: 10.7270/Q2RF5ZJK
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93137 (PDE5 Inhibitor, 9) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93135 (PDE5 Inhibitor, 1) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars		n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
Transmembrane protease serine 2 (Homo sapiens (Human))	BDBM420294 (8008-1235 \| N-[4-(4-chlorophenyl)-3-ethyl-1,3-thia...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase UniChem	Article PubMed	n/a	n/a	2.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center					Assay Description To identify inhibitors of TMPRSS2 that may be used directly in clinical studies or as lead compounds to develop targeted drugs, we screened several c...				Cancer Discov 4: 1310-25 (2014) Article DOI: 10.1158/2159-8290.CD-13-1010 BindingDB Entry DOI: 10.7270/Q2HD7Z13
Fred Hutchinson Cancer Research Center					More data for this Ligand-Target Pair
Transmembrane protease serine 2 (Homo sapiens (Human))	BDBM420292 (4401-0077 \| Antidepressant agent 1) Show SMILES CCN1CCn2c3C1CCCc3c1cc(Br)ccc21 Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE UniChem	Article PubMed	n/a	n/a	2.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
Fred Hutchinson Cancer Research Center					Assay Description To identify inhibitors of TMPRSS2 that may be used directly in clinical studies or as lead compounds to develop targeted drugs, we screened several c...				Cancer Discov 4: 1310-25 (2014) Article DOI: 10.1158/2159-8290.CD-13-1010 BindingDB Entry DOI: 10.7270/Q2HD7Z13
Fred Hutchinson Cancer Research Center					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM93138 (PDE5 Inhibitor, 4) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars		n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
German University in Cairo					Assay Description PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...				International Journal of Medicinal Chemistry 2011: 1-9 (2011) BindingDB Entry DOI: 10.7270/Q21R6P59
German University in Cairo					More data for this Ligand-Target Pair
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM50349974 (CHEMBL1812485) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Yaounde Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum Enoyl-ACP reductase using crotonyl-CoA as substrate peincubated for 5 mins measured after 10 mins of substrate ad...				J Nat Prod 74: 1370-8 (2011) Article DOI: 10.1021/np100896w BindingDB Entry DOI: 10.7270/Q2WH2QC7
University of Yaounde Curated by ChEMBL					More data for this Ligand-Target Pair
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM50240896 (2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H...) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Yaounde Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum Enoyl-ACP reductase using crotonyl-CoA as substrate peincubated for 5 mins measured after 10 mins of substrate ad...				J Nat Prod 74: 1370-8 (2011) Article DOI: 10.1021/np100896w BindingDB Entry DOI: 10.7270/Q2WH2QC7
University of Yaounde Curated by ChEMBL					More data for this Ligand-Target Pair
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM50349976 (ISOWIGHTEONE) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Yaounde Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum Enoyl-ACP reductase using crotonyl-CoA as substrate peincubated for 5 mins measured after 10 mins of substrate ad...				J Nat Prod 74: 1370-8 (2011) Article DOI: 10.1021/np100896w BindingDB Entry DOI: 10.7270/Q2WH2QC7
University of Yaounde Curated by ChEMBL					More data for this Ligand-Target Pair
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM50349975 (CHEMBL1812593) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.48E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Yaounde Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum Enoyl-ACP reductase using crotonyl-CoA as substrate peincubated for 5 mins measured after 10 mins of substrate ad...				J Nat Prod 74: 1370-8 (2011) Article DOI: 10.1021/np100896w BindingDB Entry DOI: 10.7270/Q2WH2QC7
University of Yaounde Curated by ChEMBL					More data for this Ligand-Target Pair