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3 similar compounds to monomer 50126829

Wt: 322.3
BDBM50240945
Purchase
Wt: 352.3
BDBM50241694
Wt: 366.4
BDBM50386072

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50240945,50241694,50386072   
Target
(Institution)
LigandTarget
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
pHTemp
°C
Ornithine decarboxylase


(Homo sapiens)
BDBM50240945
PNG
((E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(...)
Show SMILES CC1(C)Oc2ccc(C(=O)\C=C\c3ccc(O)cc3)c(O)c2C=C1
Show InChI InChI=1S/C20H18O4/c1-20(2)12-11-16-18(24-20)10-8-15(19(16)23)17(22)9-5-13-3-6-14(21)7-4-13/h3-12,21,23H,1-2H3/b9-5+
PDB
MMDB

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PC sid
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Article
PubMed
n/an/a 4.70E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of phorbol ester-induced ornithine decraboxylase in human MCF7 cells after 6 hrs


J Nat Prod 62: 205-10 (1999)

More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (human))
BDBM50240945
PNG
((E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(...)
Show SMILES CC1(C)Oc2ccc(C(=O)\C=C\c3ccc(O)cc3)c(O)c2C=C1
Show InChI InChI=1S/C20H18O4/c1-20(2)12-11-16-18(24-20)10-8-15(19(16)23)17(22)9-5-13-3-6-14(21)7-4-13/h3-12,21,23H,1-2H3/b9-5+
PDB
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Article
PubMed
n/an/a 7.41E+4n/an/an/an/an/an/a



Toho University

Curated by ChEMBL


Assay Description
Inhibition of PTP1B (unknown origin) using p-nitrophenyl phosphate as substrate


Bioorg Med Chem Lett 23: 5836-9 (2013)

More data for this
Ligand-Target Pair
Nitric Oxide Synthase, inducible


(Mus musculus (mouse))
BDBM50386072
PNG
(CHEMBL2043072)
Show SMILES COc1ccc(\C=C\C(=O)c2ccc3OC(C)(C)C=Cc3c2O)cc1OC
Show InChI InChI=1S/C22H22O5/c1-22(2)12-11-16-18(27-22)10-7-15(21(16)24)17(23)8-5-14-6-9-19(25-3)20(13-14)26-4/h5-13,24H,1-4H3/b8-5+
PDB
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Article
PubMed
n/an/a 7.90E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of iNOS in mouse RAW264.7 cells assessed as inhibition of LPS-induced nitric oxide production for 2 hrs by DAF-FMDA dye based fluorometric...


Eur J Med Chem 54: 272-80 (2012)

More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Homo sapiens)
BDBM50241694
PNG
(3-methoxy-4-hydroxylonchocarpin | CHEMBL463206)
Show SMILES COc1cc(\C=C\C(=O)c2ccc3OC(C)(C)C=Cc3c2O)ccc1O
Show InChI InChI=1S/C21H20O5/c1-21(2)11-10-15-18(26-21)9-6-14(20(15)24)16(22)7-4-13-5-8-17(23)19(12-13)25-3/h4-12,23-24H,1-3H3/b7-4+
PDB
MMDB

NCI pathway
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KEGG

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PC sid
UniChem

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Article
PubMed
n/an/a 3.60E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of phorbol ester-induced ornithine decraboxylase in human MCF7 cells after 6 hrs


J Nat Prod 62: 205-10 (1999)

More data for this
Ligand-Target Pair