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2 similar compounds to monomer 50053997

Compile data set for download or QSAR
Wt: 310.8
BDBM50054011
Wt: 296.7
BDBM50054013

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50054011,50054013   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50054011
PNG
((E)-6-(3-Chloro-6-methoxy-2,4,5-trimethyl-phenyl)-...)
Show SMILES COc1c(C)c(C)c(Cl)c(C)c1C\C=C(/C)CCC(O)=O
Show InChI InChI=1S/C17H23ClO3/c1-10(7-9-15(19)20)6-8-14-13(4)16(18)11(2)12(3)17(14)21-5/h6H,7-9H2,1-5H3,(H,19,20)/b10-6+
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant type II Inosine Monophosphate Dehydrogenase at 100 microM


J Med Chem 39: 4181-96 (1996)


Article DOI: 10.1021/jm9603633
BindingDB Entry DOI: 10.7270/Q2668C8Q
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50054013
PNG
((E)-6-(5-Chloro-2-methoxy-3,4-dimethyl-phenyl)-4-m...)
Show SMILES COc1c(C)c(C)c(Cl)cc1C\C=C(/C)CCC(O)=O
Show InChI InChI=1S/C16H21ClO3/c1-10(6-8-15(18)19)5-7-13-9-14(17)11(2)12(3)16(13)20-4/h5,9H,6-8H2,1-4H3,(H,18,19)/b10-5+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 537n/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant inosine monophosphate dehydrogenase type II .


J Med Chem 39: 4181-96 (1996)


Article DOI: 10.1021/jm9603633
BindingDB Entry DOI: 10.7270/Q2668C8Q
More data for this
Ligand-Target Pair