BindingDB logo
myBDB logout

PubMed code 18512985

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Xanthine dehydrogenase/oxidase


(Homo sapiens (Human))		BDBM35440
PNG
(ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...)
Show SMILES O=c1[nH]cnc2n[nH]cc12
Show InChI InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Kaohsiung Medical University

Curated by ChEMBL


Assay Description
Inhibition of xanthine oxidase (unknown origin)

J Nat Prod 71: 1027-31 (2008)


Article DOI: 10.1021/np8001145
BindingDB Entry DOI: 10.7270/Q25T3K7R
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Homo sapiens (Human))		BDBM50244273
PNG
(CHEMBL470950 | CHEMBL511791 | Hyperielliptone HB)
Show SMILES [#6]-[#6]-[#6](-[#6])-[#6](=O)-[#6]-1-[#6](=O)[C@@]([#6])([#6]\[#6]=[#6](\[#6])-[#6])[#6](=O)[C@@]2([#6]-[#6@H]3-[#6@H](-[#6]-[#6][C@@]3([#6])[#8])[C@]([#6])([#8])[#6]2)[#6]-1=O |r|
Show InChI InChI=1S/C27H40O6/c1-8-16(4)20(28)19-21(29)24(5,11-9-15(2)3)23(31)27(22(19)30)13-18-17(26(7,33)14-27)10-12-25(18,6)32/h9,16-19,32-33H,8,10-14H2,1-7H3/t16?,17-,18-,19?,24+,25+,26+,27+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.21E+4n/an/an/an/an/an/a



Kaohsiung Medical University

Curated by ChEMBL


Assay Description
Inhibition of xanthine oxidase (unknown origin)

J Nat Prod 71: 1027-31 (2008)


Article DOI: 10.1021/np8001145
BindingDB Entry DOI: 10.7270/Q25T3K7R
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Homo sapiens (Human))		BDBM50244273
PNG
(CHEMBL470950 | CHEMBL511791 | Hyperielliptone HB)
Show SMILES [#6]-[#6]-[#6](-[#6])-[#6](=O)-[#6]-1-[#6](=O)[C@@]([#6])([#6]\[#6]=[#6](\[#6])-[#6])[#6](=O)[C@@]2([#6]-[#6@H]3-[#6@H](-[#6]-[#6][C@@]3([#6])[#8])[C@]([#6])([#8])[#6]2)[#6]-1=O |r|
Show InChI InChI=1S/C27H40O6/c1-8-16(4)20(28)19-21(29)24(5,11-9-15(2)3)23(31)27(22(19)30)13-18-17(26(7,33)14-27)10-12-25(18,6)32/h9,16-19,32-33H,8,10-14H2,1-7H3/t16?,17-,18-,19?,24+,25+,26+,27+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.21E+4n/an/an/an/an/an/a



Kaohsiung Medical University

Curated by ChEMBL


Assay Description
Inhibition of xanthine oxidase (unknown origin)

J Nat Prod 71: 1027-31 (2008)


Article DOI: 10.1021/np8001145
BindingDB Entry DOI: 10.7270/Q25T3K7R
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%