Found 594 hits with Last Name = 'sager' and Initial = 'c' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50230882
(CARBOXYLIC ACID METABOLITE | CHEBI:74125 | E-3174)Show SMILES CCCCc1nc(Cl)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1 Show InChI InChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Basel
Curated by ChEMBL
| Assay Description
Inhibition of ATR1 (unknown origin) |
J Med Chem 62: 8915-8930 (2019)
Article DOI: 10.1021/acs.jmedchem.9b00179
BindingDB Entry DOI: 10.7270/Q2377CZQ |
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620313
(US20230295182, Example 1.45 | US20230295182, Examp...)Show SMILES COC1=C(N2C[C@@H](NN2)c2ccc(Cl)c(F)c2F)C(O)=C(CO)O[C@@H]1CC1=NO[C@@]2(C1)CC[C@@H](CC2)NC(=O)OC(C)(C)C |wU:29.31,6.9,24.27,wD:33.40,c:2,t:21,29,(-1.33,-.88,;-2.23,-2.13,;-3.76,-1.97,;-4.39,-.56,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-5.92,-.4,;-6.55,1.01,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-6.2,-3.05,;-4.67,-3.21,;-4.04,-4.62,;-2.51,-4.78,;-1.74,-6.11,;-.23,-5.79,;-.07,-4.26,;-1.48,-3.64,;-.07,-2.72,;1.26,-1.95,;2.59,-2.72,;2.59,-4.26,;1.26,-5.03,;3.93,-1.95,;5.26,-2.72,;5.26,-4.26,;6.6,-1.95,;7.93,-2.72,;9.26,-1.95,;9.26,-3.49,;7.93,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620309
(US20230295182, Example 1.41 | US20230295182, Examp...)Show SMILES COC1=C(N2C[C@@H](NN2)c2ccc(F)c(F)c2F)C(O)=C(CO)O[C@@H]1CC1=NO[C@@]2(C1)CC[C@@H](CC2)NC(=O)OC(C)(C)C |wU:29.31,6.9,24.27,wD:33.40,c:2,t:21,29,(-1.33,-.88,;-2.23,-2.13,;-3.76,-1.97,;-4.39,-.56,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-5.92,-.4,;-6.55,1.01,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-6.2,-3.05,;-4.67,-3.21,;-4.04,-4.62,;-2.51,-4.78,;-1.74,-6.11,;-.23,-5.79,;-.07,-4.26,;-1.48,-3.64,;-.07,-2.72,;1.26,-1.95,;2.59,-2.72,;2.59,-4.26,;1.26,-5.03,;3.93,-1.95,;5.26,-2.72,;5.26,-4.26,;6.6,-1.95,;7.93,-2.72,;9.26,-1.95,;9.26,-3.49,;7.93,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632517
((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/a | n/a | 12.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632544
((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/a | n/a | 12.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632510
((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/a | n/a | 13.6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632552
((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/a | n/a | 14.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632505
((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/a | n/a | 14.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620311
(US20230295182, Example 1.43 | US20230295182, Examp...)Show SMILES COC1=C(N2C[C@@H](NN2)c2ccc(C)c(F)c2F)C(O)=C(CO)O[C@@H]1CC1=NO[C@@]2(C1)CC[C@@H](CC2)NC(=O)OC(C)(C)C |wU:29.31,6.9,24.27,wD:33.40,c:2,t:21,29,(-1.33,-.88,;-2.23,-2.13,;-3.76,-1.97,;-4.39,-.56,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-5.92,-.4,;-6.55,1.01,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-6.2,-3.05,;-4.67,-3.21,;-4.04,-4.62,;-2.51,-4.78,;-1.74,-6.11,;-.23,-5.79,;-.07,-4.26,;-1.48,-3.64,;-.07,-2.72,;1.26,-1.95,;2.59,-2.72,;2.59,-4.26,;1.26,-5.03,;3.93,-1.95,;5.26,-2.72,;5.26,-4.26,;6.6,-1.95,;7.93,-2.72,;9.26,-1.95,;9.26,-3.49,;7.93,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632502
((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/a | n/a | 15.1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632547
((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/a | n/a | 16.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632478
((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/a | n/a | 16.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620359
(US20230295182, Example 2.09 | ethyl ((5r,8R)-3-(((...)Show SMILES CCOC(=O)N[C@H]1CC[C@@]2(CC(C[C@H]3O[C@H](CO)[C@H](O)[C@@H]([C@H]3OC)n3cc(nn3)-c3ccc(C)c(F)c3F)=NO2)CC1 |wU:9.42,21.22,13.12,wD:15.15,18.18,20.24,6.5,c:40,(9.26,-1.95,;7.93,-2.72,;6.6,-1.95,;5.26,-2.72,;5.26,-4.26,;3.93,-1.95,;2.59,-2.72,;1.26,-1.95,;-.07,-2.72,;-.07,-4.26,;-1.48,-3.64,;-2.51,-4.78,;-4.04,-4.62,;-4.67,-3.21,;-6.2,-3.05,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-5.92,-.4,;-6.55,1.01,;-4.39,-.56,;-3.76,-1.97,;-2.23,-2.13,;-1.33,-.88,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-1.74,-6.11,;-.23,-5.79,;1.26,-5.03,;2.59,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632606
((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/a | n/a | 17.1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632513
((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/a | n/a | 17.1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632476
((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/a | n/a | 17.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632519
((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/a | n/a | 17.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620361
(US20230295182, Example 2.11 | ethyl ((5r,8R)-3-(((...)Show SMILES CCOC(=O)N[C@H]1CC[C@@]2(CC(C[C@H]3O[C@H](CO)[C@H](O)[C@@H]([C@H]3OC)n3cc(nn3)-c3ccc(Cl)c(F)c3F)=NO2)CC1 |wU:9.42,21.22,13.12,wD:15.15,18.18,20.24,6.5,c:40,(9.26,-1.95,;7.93,-2.72,;6.6,-1.95,;5.26,-2.72,;5.26,-4.26,;3.93,-1.95,;2.59,-2.72,;1.26,-1.95,;-.07,-2.72,;-.07,-4.26,;-1.48,-3.64,;-2.51,-4.78,;-4.04,-4.62,;-4.67,-3.21,;-6.2,-3.05,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-5.92,-.4,;-6.55,1.01,;-4.39,-.56,;-3.76,-1.97,;-2.23,-2.13,;-1.33,-.88,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-1.74,-6.11,;-.23,-5.79,;1.26,-5.03,;2.59,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632551
((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/a | n/a | 19.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632546
((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/a | n/a | 19.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632553
((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/a | n/a | 19.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM620360
(US20230295182, Example 2.10 | ethyl ((5r,8R)-3-(((...)Show SMILES CCOC(=O)N[C@H]1CC[C@@]2(CC(C[C@H]3O[C@H](CO)[C@H](O)[C@@H]([C@H]3OC)n3cc(nn3)-c3ccc(F)c(F)c3F)=NO2)CC1 |wU:9.42,21.22,13.12,wD:20.24,15.15,18.18,6.5,c:40,(9.26,-1.95,;7.93,-2.72,;6.6,-1.95,;5.26,-2.72,;5.26,-4.26,;3.93,-1.95,;2.59,-2.72,;1.26,-1.95,;-.07,-2.72,;-.07,-4.26,;-1.48,-3.64,;-2.51,-4.78,;-4.04,-4.62,;-4.67,-3.21,;-6.2,-3.05,;-6.83,-1.65,;-8.36,-1.48,;-9.26,-2.73,;-5.92,-.4,;-6.55,1.01,;-4.39,-.56,;-3.76,-1.97,;-2.23,-2.13,;-1.33,-.88,;-3.48,.69,;-1.94,.69,;-1.47,2.15,;-2.71,3.06,;-3.96,2.15,;-0,2.63,;1.14,1.6,;2.61,2.07,;2.93,3.58,;4.39,4.05,;1.78,4.61,;2.1,6.11,;.32,4.13,;-.83,5.16,;-1.74,-6.11,;-.23,-5.79,;1.26,-5.03,;2.59,-4.26,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632487
((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/a | n/a | 21.2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632511
((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/a | n/a | 21.2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632508
((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/a | n/a | 21.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632503
((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/a | n/a | 21.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632550
((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/a | n/a | 22.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632491
((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/a | n/a | 22.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632457
((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/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632542
((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/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632507
((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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 23.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632543
((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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 25.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632470
((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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 25.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632520
((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/a | n/a | 25.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632484
((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/a | n/a | 25.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632540
((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/a | n/a | 25.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632612
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 25.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632545
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 26.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632456
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 27.3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632482
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 28.6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632541
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 28.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632471
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 28.8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632549
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 28.9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632622
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632548
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 29.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632469
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 29.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632533
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 29.7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632463
((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
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632515
((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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 33.2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Galectin-3
(Homo sapiens (Human)) | BDBM632485
((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
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 33.4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
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