BDBM50494924 CHEMBL2437262
SMILES: COC(=O)[C@H](NC(=O)CC\C(C)=C\Cc1c(O)c2C(=O)OCc2c(C)c1OC)C(C)C
InChI Key: InChIKey=OYQABFQINYYQSH-HBAHQKBISA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50494924 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 |
|---|
Inosine-5'-monophosphate dehydrogenase (IMPDH)
(Homo sapiens (Human)) | BDBM50494924
(CHEMBL2437262)Show SMILES COC(=O)[C@H](NC(=O)CC\C(C)=C\Cc1c(O)c2C(=O)OCc2c(C)c1OC)C(C)C |r| Show InChI InChI=1S/C23H31NO7/c1-12(2)19(23(28)30-6)24-17(25)10-8-13(3)7-9-15-20(26)18-16(11-31-22(18)27)14(4)21(15)29-5/h7,12,19,26H,8-11H2,1-6H3,(H,24,25)/b13-7+/t19-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 1.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Minnesota
Curated by ChEMBL
| Assay Description
Inhibition of IMPDH2 (unknown origin) |
Bioorg Med Chem Lett 24: 332-6 (2014)
Article DOI: 10.1016/j.bmcl.2013.11.005
BindingDB Entry DOI: 10.7270/Q2BP05RJ |
More data for this
Ligand-Target Pair | |
Lanosterol synthase
(Homo sapiens (Human)) | BDBM50494924
(CHEMBL2437262)Show SMILES COC(=O)[C@H](NC(=O)CC\C(C)=C\Cc1c(O)c2C(=O)OCc2c(C)c1OC)C(C)C |r| Show InChI InChI=1S/C23H31NO7/c1-12(2)19(23(28)30-6)24-17(25)10-8-13(3)7-9-15-20(26)18-16(11-31-22(18)27)14(4)21(15)29-5/h7,12,19,26H,8-11H2,1-6H3,(H,24,25)/b13-7+/t19-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| 7.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Minnesota
Curated by ChEMBL
| Assay Description
Inhibition of IMPDH1 (unknown origin) |
Bioorg Med Chem Lett 24: 332-6 (2014)
Article DOI: 10.1016/j.bmcl.2013.11.005
BindingDB Entry DOI: 10.7270/Q2BP05RJ |
More data for this
Ligand-Target Pair | |
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