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Compile Data Set for Download or QSAR

Found 4 hits of kd for UniProtKB: P11762   
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
Galectin-1


(Rattus norvegicus)
BDBM50591132
PNG
(CHEMBL5182222)
Show SMILES OC[C@H]1O[C@H](Sc2cncc(Br)c2)[C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1 |r|
PDB
MMDB

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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/an/a 3.17E+3n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00660
BindingDB Entry DOI: 10.7270/Q2V69PJ9
More data for this
Ligand-Target Pair
Galectin-1


(Rattus norvegicus)
BDBM50591130
PNG
(CHEMBL5181579)
Show SMILES OC[C@H]1O[C@H](Sc2ccc(Cl)c(Cl)c2)[C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1 |r|
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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/an/a 3.70E+3n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00660
BindingDB Entry DOI: 10.7270/Q2V69PJ9
More data for this
Ligand-Target Pair
Galectin-1


(Rattus norvegicus)
BDBM50591131
PNG
(CHEMBL5193805)
Show SMILES OC[C@H]1O[C@H](Sc2ccc(C#N)c(Cl)c2)[C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1 |r|
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PC cid
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UniChem
Article
PubMed
n/an/an/a 5.18E+3n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00660
BindingDB Entry DOI: 10.7270/Q2V69PJ9
More data for this
Ligand-Target Pair
Galectin-1


(Rattus norvegicus)
BDBM50077225
PNG
((2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2S,3R,4S,5...)
Show SMILES OC[C@H]1O[C@@H](S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C12H22O10S/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5+,6+,7+,8+,9-,10-,11+,12+/m1/s1
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CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

PDB
Article
PubMed
n/an/an/a 2.40E+4n/an/an/an/an/a



Institute of Science Education and Research-Kolkata (IISER) Kolkata

Curated by ChEMBL


Assay Description
Competitive binding affinity to rat galectin-1 after 5 mins in presence of fluorescent probe by fluorescence polarization assay


J Med Chem 59: 8141-7 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00957
BindingDB Entry DOI: 10.7270/Q2X63RF4
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)