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SMILES: CC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1

InChI Key: InChIKey=LZDBRAMBTQQSII-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50201928   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
P-selectin glycoprotein ligand 1


(Homo sapiens (Human))
BDBM50201928
PNG
(2-(4-chlorophenyl)-3-hydroxy-8-isopropylquinoline-...)
Show SMILES CC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H16ClNO3/c1-10(2)13-4-3-5-14-15(19(23)24)18(22)16(21-17(13)14)11-6-8-12(20)9-7-11/h3-10,22H,1-2H3,(H,23,24)
NCI pathway
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.25E+5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of P-selectin-mediated adhesion of HL60 cells


J Med Chem 50: 21-39 (2007)


Article DOI: 10.1021/jm0602256
BindingDB Entry DOI: 10.7270/Q2Z60PVV
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50201928
PNG
(2-(4-chlorophenyl)-3-hydroxy-8-isopropylquinoline-...)
Show SMILES CC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H16ClNO3/c1-10(2)13-4-3-5-14-15(19(23)24)18(22)16(21-17(13)14)11-6-8-12(20)9-7-11/h3-10,22H,1-2H3,(H,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.83E+5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DHOD expressed in Escherichia coli


J Med Chem 50: 21-39 (2007)


Article DOI: 10.1021/jm0602256
BindingDB Entry DOI: 10.7270/Q2Z60PVV
More data for this
Ligand-Target Pair