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BDBM50399361 CHEMBL2079375

SMILES: OC[C@H]1O[C@H](Oc2ccc(cc2Cl)-n2ccc3cc(ccc23)C(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O

InChI Key: InChIKey=UPSQJAOEPOVWAK-AGRFSFNASA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50399361   
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
Macrophage mannose receptor 1


(Homo sapiens (Human))
BDBM50399361
PNG
(CHEMBL2079375)
Show SMILES OC[C@H]1O[C@H](Oc2ccc(cc2Cl)-n2ccc3cc(ccc23)C(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C21H20ClNO8/c22-13-8-12(23-6-5-10-7-11(20(28)29)1-3-14(10)23)2-4-15(13)30-21-19(27)18(26)17(25)16(9-24)31-21/h1-8,16-19,21,24-27H,9H2,(H,28,29)/t16-,17-,18+,19+,21+/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+6n/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Displacement of biotinylated-TM PAA from human MMR after 3 hrs by colorimetry


J Med Chem 55: 9810-6 (2012)


Article DOI: 10.1021/jm3010338
BindingDB Entry DOI: 10.7270/Q2RV0PT3
More data for this
Ligand-Target Pair