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1 similar compounds to monomer 50111453

Compile data set for download or QSAR
Wt: 1154.0
BDBM50111452

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50111452   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
P-selectin/P-selectin glycoprotein ligand 1


(Homo sapiens (Human))
BDBM50111452
PNG
((4R,5S)-5-[({[6-({[(1S)-1,3-dicarboxypropyl]carbam...)
Show SMILES C[C@@H]1O[C@@H](OC2C(NC(C)=O)C(O)O[C@@H](CO)[C@H]2OC2OC(CO)[C@H](O)[C@H](OC3(C[C@@H](O)[C@H](NC(=O)NCC4OC(CC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)C(O)C4O)C(O3)[C@H](O)[C@H](O)CO)C([O-])=O)[C@@H]2O)C(O)C(O)C1O
Show InChI InChI=1S/C43H70N4O32/c1-11-24(57)29(62)31(64)39(72-11)77-35-23(45-12(2)51)38(68)74-19(10-50)33(35)76-40-32(65)36(28(61)18(9-49)75-40)79-43(41(69)70)6-14(52)22(34(78-43)25(58)15(53)8-48)47-42(71)44-7-17-27(60)30(63)26(59)16(73-17)5-20(54)46-13(37(66)67)3-4-21(55)56/h11,13-19,22-36,38-40,48-50,52-53,57-65,68H,3-10H2,1-2H3,(H,45,51)(H,46,54)(H,55,56)(H,66,67)(H,69,70)(H2,44,47,71)/p-1/t11-,13-,14+,15+,16?,17?,18?,19-,22-,23?,24?,25+,26?,27?,28-,29?,30?,31?,32-,33+,34?,35?,36-,38?,39-,40?,43?/m0/s1
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEBI
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+8n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of P-selectin glycoprotein ligand 1 (PSGL-1) fusion protein to immobilized soluble P-selectin in a P-selectin assay.


J Med Chem 45: 1563-6 (2002)


Article DOI: 10.1021/jm010390f
BindingDB Entry DOI: 10.7270/Q27W6CZ4
More data for this
Ligand-Target Pair