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Compile Data Set for Download or QSAR

Found 352 hits Enz. Inhib. hit(s) with all data for entry = 11605   
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
Galectin-3


(Homo sapiens (Human))
BDBM632517
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-2,3-difluorophenyl...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Cl)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 12.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632544
PNG
((2R,3R,4S,5R,6R)-2-((3,5-dichlorophenyl)((1S,2S)-2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 12.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632510
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-2,3-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Br)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 13.6n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632552
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-3,5-difluorophenyl...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 14.3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632505
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(2...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 14.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632502
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dichlorophenyl)-4-(4-(2,3-...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 15.1n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632547
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-3,5-difluorophenyl...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 16.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632478
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(3...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 16.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632606
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(2...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1F)C(=O)N([C@H]1CC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 17.1n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632513
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(3...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 17.1n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632476
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-4-(4-(...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 17.3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632519
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(4...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Cl)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 17.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632551
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-4-(4-(...)
Show SMILES Cc1c(F)cc(cc1F)-c1cn(nn1)[C@H]1[C@@H](O)[C@@H](CO)O[C@H]([C@@H]1O)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 19.3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632546
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-3,5-difluorophenyl...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 19.8n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632553
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-3,5-difluorophenyl...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 19.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632487
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(3...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(Cl)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 21.2n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632511
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-2,3-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Br)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(F)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 21.2n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632508
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-2,3-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Br)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 21.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632503
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-4-(4-(...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 21.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632550
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dichlorophenyl)-4-(4-(3,5-...)
Show SMILES Cc1c(F)cc(cc1F)-c1cn(nn1)[C@H]1[C@@H](O)[C@@H](CO)O[C@H]([C@@H]1O)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 22.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632491
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(3...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)cc(Cl)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 22.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632457
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-5-hydro...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 23n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632542
PNG
((2R,3R,4S,5R,6R)-2-((3,5-dichlorophenyl)((1S,2S)-2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 23n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632507
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-2,3-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Br)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 23.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632543
PNG
((2R,3R,4S,5R,6R)-2-((3-chloro-5-cyanophenyl)((1S,2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632470
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(3...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(OC)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632520
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(4...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Cl)c(F)c1F)C(=O)N([C@@H]1CCC[C@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632484
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-3,5-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Br)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632540
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-5-hydr...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(F)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.7n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632612
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-2,3-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(Br)c(F)c1F)C(=O)N([C@H]1CC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
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UniChem
n/an/a 25.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632545
PNG
((2R,3R,4S,5R,6R)-2-((3-chloro-5-cyanophenyl)((1S,2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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n/an/a 26.8n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632456
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-5-hydr...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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n/an/a 27.3n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632482
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-bromo-3,5-difluorophenyl)...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Br)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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n/an/a 28.6n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632541
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-5-hydro...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(F)c(F)c1F)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
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n/an/a 28.7n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632471
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dibromophenyl)-4-(4-(3,4-d...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(OC)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(Br)c1
PDB
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n/an/a 28.8n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632549
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-3,5-di...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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PC sid
UniChem
n/an/a 28.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632622
PNG
((2R,3R,4S,5R,6R)-2-((3,5-dichlorophenyl)((1S,2S)-2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
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n/an/a 29n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632548
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dichlorophenyl)-3,5-dihydr...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
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n/an/a 29.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632469
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dichlorophenyl)-4-(4-(3,4-...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(OC)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(Cl)c1
PDB
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n/an/a 29.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632533
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-4-(4-(...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Cl)c(Cl)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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n/an/a 29.7n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632463
PNG
((2R,3R,4S,5R,6R)-N-(3,5-dibromophenyl)-5-hydroxy-N...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(Br)c1
PDB
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n/an/a 31n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632515
PNG
((2R,3R,4S,5R,6R)-N-(3-cyano-5-methylphenyl)-4-(4-(...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1ccc(C)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(C)cc(c1)C#N
PDB
MMDB

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antibodypedia
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PC sid
UniChem
n/an/a 33.2n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632485
PNG
((2R,3R,4S,5R,6R)-4-(4-(3-chloro-4,5-difluorophenyl...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(Cl)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

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n/an/a 33.4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632626
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-cyanophenyl)-3,5-di...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@H]([C@H]1O)n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
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n/an/a 33.8n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632481
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-cyanophenyl)-4-(4-(4...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Br)cc(c1)C#N
PDB
MMDB

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antibodypedia
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n/an/a 33.9n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632465
PNG
((2R,3R,4S,5R,6R)-N-(3-bromo-5-methylphenyl)-5-hydr...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(C)cc(Br)c1
PDB
MMDB

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n/an/a 34.7n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632455
PNG
((2R,3R,4S,5R,6R)-N-(3-chloro-5-methylphenyl)-5-hyd...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(C)cc(Cl)c1
PDB
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n/an/a 34.8n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632623
PNG
((2R,3R,4S,5R,6R)-2-((3-chloro-5-cyanophenyl)((1S,2...)
Show SMILES CC(=O)O[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

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PC sid
UniChem
n/an/a 36.2n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632452
PNG
((2R,3R,4S,5R,6R)-N-(3-chlorophenyl)-5-hydroxy-N-((...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(F)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cccc(Cl)c1
PDB
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n/an/a 36.5n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Galectin-3


(Homo sapiens (Human))
BDBM632479
PNG
((2R,3R,4S,5R,6R)-4-(4-(4-chloro-3,5-difluorophenyl...)
Show SMILES CO[C@H]1[C@@H](O[C@H](CO)[C@H](O)[C@@H]1n1cc(nn1)-c1cc(F)c(Cl)c(F)c1)C(=O)N([C@H]1CCC[C@@H]1O)c1cc(Cl)cc(c1)C#N
PDB
MMDB

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antibodypedia
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n/an/a 36.7n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
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