Compile Data Set for Download or QSAR

Found 85 hits of ic50 for UniProtKB: P49366   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Deoxyhypusine synthase (Homo sapiens)	BDBM50612294 (CHEMBL5281395) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PDB UniChem	PDB	n/a	n/a	9.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50612293 (CHEMBL5265996) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612290 (CHEMBL5288132) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612285 (CHEMBL5269564) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PDB UniChem	PDB	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50583904 (CHEMBL5091313) Show SMILES COc1ccccc1Oc1c(N)nc(nc1Cl)-c1ccc(Br)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612287 (CHEMBL5274333) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PDB UniChem	PDB	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50612292 (CHEMBL5268272) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612295 (CHEMBL5267547) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612291 (CHEMBL5278471) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583911 (CHEMBL5079375) Show SMILES COc1cccc(c1)-c1nc(N)c(Oc2ccccc2OC)c(Cl)n1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583914 (CHEMBL5074971) Show SMILES COc1ccccc1Oc1c(N)nc(Cc2ccccc2)nc1Cl Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514710 (CHEMBL4555677) Show SMILES Brc1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C17H11BrN2OS/c18-11-5-4-10-8-16(22-15(10)9-11)17(21)20-14-3-1-2-13-12(14)6-7-19-13/h1-9,19H,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	PDB	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50514710 (CHEMBL4555677) Show SMILES Brc1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C17H11BrN2OS/c18-11-5-4-10-8-16(22-15(10)9-11)17(21)20-14-3-1-2-13-12(14)6-7-19-13/h1-9,19H,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50612294 (CHEMBL5281395) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PDB UniChem	PDB	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50514715 (CHEMBL4543218) Show SMILES Ic1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C17H11IN2OS/c18-11-5-4-10-8-16(22-15(10)9-11)17(21)20-14-3-1-2-13-12(14)6-7-19-13/h1-9,19H,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	92	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583906 (CHEMBL5075342) Show SMILES COc1ccccc1Oc1c(N)nc(nc1Cl)-c1ccc(Cl)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612289 (CHEMBL5282634) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514717 (CHEMBL4462702) Show SMILES Clc1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C17H11ClN2OS/c18-11-5-4-10-8-16(22-15(10)9-11)17(21)20-14-3-1-2-13-12(14)6-7-19-13/h1-9,19H,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50216786 (CHEMBL229457 | N-(7-Amino-heptyl)-guanidine | N-gu...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] Show InChI InChI=1S/C8H20N4/c9-6-4-2-1-3-5-7-12-8(10)11/h1-7,9H2,(H4,10,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612288 (CHEMBL5281552) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612286 (CHEMBL5287156) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612290 (CHEMBL5288132) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583902 (CHEMBL5091281) Show SMILES COc1ccccc1Oc1c(N)nc(nc1Cl)-c1ccc(I)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583898 (CHEMBL5084409) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1ccc(C)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612293 (CHEMBL5265996) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583900 (CHEMBL5090481) Show SMILES COc1ccccc1Oc1c(N)nc(Cc2ccccc2)nc1OCCO Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583895 (CHEMBL5078063) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1cccc(F)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612285 (CHEMBL5269564) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PDB UniChem	PDB	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50514706 (CHEMBL4442298) Show SMILES O=C(Nc1cccc2[nH]ccc12)c1cc2ccc(cc2s1)C#N Show InChI InChI=1S/C18H11N3OS/c19-10-11-4-5-12-9-17(23-16(12)8-11)18(22)21-15-3-1-2-14-13(15)6-7-20-14/h1-9,20H,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612284 (CHEMBL5283409) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50216786 (CHEMBL229457 | N-(7-Amino-heptyl)-guanidine | N-gu...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] Show InChI InChI=1S/C8H20N4/c9-6-4-2-1-3-5-7-12-8(10)11/h1-7,9H2,(H4,10,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Competitive inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction i...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583915 (CHEMBL5091279) Show SMILES COc1ccccc1Oc1c(N)nc(nc1Cl)-c1ccccc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583889 (CHEMBL5070084) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1cccc(I)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612291 (CHEMBL5278471) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612295 (CHEMBL5267547) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583908 (CHEMBL5081296) Show SMILES COc1ccccc1Oc1c(N)nc(nc1Cl)-c1ccc(F)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612292 (CHEMBL5268272) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514699 (CHEMBL4447948) Show SMILES CC(C)(C)c1ccc(cc1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C19H20N2O/c1-19(2,3)14-9-7-13(8-10-14)18(22)21-17-6-4-5-16-15(17)11-12-20-16/h4-12,20H,1-3H3,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583899 (CHEMBL5075319) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1cccc(C)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50216786 (CHEMBL229457 | N-(7-Amino-heptyl)-guanidine | N-gu...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] Show InChI InChI=1S/C8H20N4/c9-6-4-2-1-3-5-7-12-8(10)11/h1-7,9H2,(H4,10,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583888 (CHEMBL5089864) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1ccc(I)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514698 (CHEMBL4470208) Show SMILES O=C(Nc1cccc2[nH]ccc12)c1cc2ccccc2s1 Show InChI InChI=1S/C17H12N2OS/c20-17(16-10-11-4-1-2-7-15(11)21-16)19-14-6-3-5-13-12(14)8-9-18-13/h1-10,18H,(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583894 (CHEMBL5080635) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1ccc(F)cc1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583891 (CHEMBL5080971) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1cccc(Br)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583893 (CHEMBL5073964) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1cccc(Cl)c1 Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.42E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514714 (CHEMBL4572958) Show SMILES CC(C)(C)c1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C21H20N2OS/c1-21(2,3)14-8-7-13-11-19(25-18(13)12-14)20(24)23-17-6-4-5-16-15(17)9-10-22-16/h4-12,22H,1-3H3,(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction in radiolabel...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50583896 (CHEMBL5078229) Show SMILES COc1ccccc1Oc1c(N)nc(nc1OCCO)-c1ccccc1F Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DHPS (unknown origin ) incubated for 30 mins by NAD/NADH-Glow assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00582 BindingDB Entry DOI: 10.7270/Q2BV7MH5
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50612280 (CHEMBL5269301) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Deoxyhypusine synthase (Homo sapiens)	BDBM50514710 (CHEMBL4555677) Show SMILES Brc1ccc2cc(sc2c1)C(=O)Nc1cccc2[nH]ccc12 Show InChI InChI=1S/C17H11BrN2OS/c18-11-5-4-10-8-16(22-15(10)9-11)17(21)20-14-3-1-2-13-12(14)6-7-19-13/h1-9,19H,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Competitive inhibition of human N-terminal His6-tagged TEV protease site linked DHPS expressed in Escherichia coli BL21 (DE3) assessed as reduction i...				J Med Chem 63: 3215-3226 (2020) Article DOI: 10.1021/acs.jmedchem.9b01979 BindingDB Entry DOI: 10.7270/Q2K35Z1V
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxyhypusine synthase (Homo sapiens)	BDBM50612278 (CHEMBL5281757) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem		n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair

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