Found 5 hits of Enzyme Inhibition Constant Data 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 |
|---|
Delta-aminolevulinic acid dehydratase
(Homo sapiens (Human)) | BDBM50441097
(CHEMBL2430564)Show InChI InChI=1S/C11H7ClO2S/c12-9-3-1-7(2-4-9)8-5-10(11(13)14)15-6-8/h1-6H,(H,13,14) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.53E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University Hospital of Bonn
Curated by ChEMBL
| Assay Description
Inhibition of human ALADH after 20 mins |
Bioorg Med Chem Lett 23: 5558-62 (2013)
Article DOI: 10.1016/j.bmcl.2013.08.052
BindingDB Entry DOI: 10.7270/Q2FQ9Z2S |
More data for this
Ligand-Target Pair | |
Delta-aminolevulinic acid dehydratase
(Homo sapiens (Human)) | BDBM50441098
(CHEMBL2430563)Show InChI InChI=1S/C11H7BrO2S/c12-9-3-1-7(2-4-9)8-5-10(11(13)14)15-6-8/h1-6H,(H,13,14) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.97E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University Hospital of Bonn
Curated by ChEMBL
| Assay Description
Inhibition of human ALADH after 20 mins |
Bioorg Med Chem Lett 23: 5558-62 (2013)
Article DOI: 10.1016/j.bmcl.2013.08.052
BindingDB Entry DOI: 10.7270/Q2FQ9Z2S |
More data for this
Ligand-Target Pair | |
Delta-aminolevulinic acid dehydratase
(Homo sapiens (Human)) | BDBM50441101
(CHEMBL2430571)Show SMILES OC(=O)c1ccc2n(Cc3ccc(F)cc3)c(=O)n(Cc3ncccn3)c2c1 Show InChI InChI=1S/C20H15FN4O3/c21-15-5-2-13(3-6-15)11-24-16-7-4-14(19(26)27)10-17(16)25(20(24)28)12-18-22-8-1-9-23-18/h1-10H,11-12H2,(H,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.19E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University Hospital of Bonn
Curated by ChEMBL
| Assay Description
Inhibition of human ALADH after 20 mins |
Bioorg Med Chem Lett 23: 5558-62 (2013)
Article DOI: 10.1016/j.bmcl.2013.08.052
BindingDB Entry DOI: 10.7270/Q2FQ9Z2S |
More data for this
Ligand-Target Pair | |
Delta-aminolevulinic acid dehydratase
(Homo sapiens (Human)) | BDBM50441099
(CHEMBL2430574)Show SMILES OC(=O)c1ccc2n(Cc3cccc(c3)C(F)(F)F)c(CCNC(=O)c3cccs3)nc2c1 Show InChI InChI=1S/C23H18F3N3O3S/c24-23(25,26)16-4-1-3-14(11-16)13-29-18-7-6-15(22(31)32)12-17(18)28-20(29)8-9-27-21(30)19-5-2-10-33-19/h1-7,10-12H,8-9,13H2,(H,27,30)(H,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University Hospital of Bonn
Curated by ChEMBL
| Assay Description
Inhibition of human ALADH after 20 mins |
Bioorg Med Chem Lett 23: 5558-62 (2013)
Article DOI: 10.1016/j.bmcl.2013.08.052
BindingDB Entry DOI: 10.7270/Q2FQ9Z2S |
More data for this
Ligand-Target Pair | |
Delta-aminolevulinic acid dehydratase
(Homo sapiens (Human)) | BDBM50441100
(CHEMBL2430572)Show SMILES OC(=O)c1ccc2n(Cc3ccc(F)cc3)c(=O)n(CCN3CCCC3)c2c1 Show InChI InChI=1S/C21H22FN3O3/c22-17-6-3-15(4-7-17)14-25-18-8-5-16(20(26)27)13-19(18)24(21(25)28)12-11-23-9-1-2-10-23/h3-8,13H,1-2,9-12,14H2,(H,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University Hospital of Bonn
Curated by ChEMBL
| Assay Description
Inhibition of human ALADH after 20 mins |
Bioorg Med Chem Lett 23: 5558-62 (2013)
Article DOI: 10.1016/j.bmcl.2013.08.052
BindingDB Entry DOI: 10.7270/Q2FQ9Z2S |
More data for this
Ligand-Target Pair | |
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