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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Hematopoietic prostaglandin D synthase' and Ligand = 'BDBM50615807'   
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
Hematopoietic prostaglandin D synthase


(Homo sapiens (Human))
BDBM50615807
PNG
(CHEMBL5290285)
Show SMILES CC(C)(O)[C@H]1CC[C@@H](CC1)NC(=O)c1cnc2nc(NCC(F)F)ccc2c1 |r,wU:7.10,wD:4.3,(9.43,4.13,;8.66,2.8,;7.89,4.13,;9.99,2.03,;7.33,2.03,;5.99,2.8,;4.66,2.03,;4.66,.49,;5.99,-.28,;7.33,.49,;3.32,-.28,;1.99,.49,;1.99,2.03,;.66,-.28,;.66,-1.82,;-.67,-2.59,;-2.01,-1.82,;-3.33,-2.59,;-4.66,-1.82,;-5.99,-2.59,;-7.33,-1.82,;-8.66,-2.59,;-8.66,-4.13,;-9.99,-1.82,;-4.66,-.3,;-3.34,.48,;-2.01,-.29,;-.68,.49,)|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 150n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Hematopoietic prostaglandin D synthase


(Rattus norvegicus)
BDBM50615807
PNG
(CHEMBL5290285)
Show SMILES CC(C)(O)[C@H]1CC[C@@H](CC1)NC(=O)c1cnc2nc(NCC(F)F)ccc2c1 |r,wU:7.10,wD:4.3,(9.43,4.13,;8.66,2.8,;7.89,4.13,;9.99,2.03,;7.33,2.03,;5.99,2.8,;4.66,2.03,;4.66,.49,;5.99,-.28,;7.33,.49,;3.32,-.28,;1.99,.49,;1.99,2.03,;.66,-.28,;.66,-1.82,;-.67,-2.59,;-2.01,-1.82,;-3.33,-2.59,;-4.66,-1.82,;-5.99,-2.59,;-7.33,-1.82,;-8.66,-2.59,;-8.66,-4.13,;-9.99,-1.82,;-4.66,-.3,;-3.34,.48,;-2.01,-.29,;-.68,.49,)|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 1.20E+4n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair