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SMILES: C[C@@]1(O)C[C@@H](C1)NC(=O)c1cnc2cc(ncc2c1)N1CCC1

InChI Key:

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50615783   
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
Hematopoietic prostaglandin D synthase


(Rattus norvegicus)
BDBM50615783
PNG
(CHEMBL5284347)
Show SMILES C[C@@]1(O)C[C@@H](C1)NC(=O)c1cnc2cc(ncc2c1)N1CCC1 |r,wU:4.6,1.1,(7.22,3.52,;6.45,2.19,;7.99,2.19,;4.96,2.58,;4.55,1.07,;6.04,.67,;3.22,.3,;1.89,1.07,;1.89,2.61,;.55,.3,;.55,-1.24,;-.78,-2,;-2.11,-1.23,;-3.43,-2,;-4.76,-1.24,;-4.76,.29,;-3.45,1.06,;-2.11,.3,;-.79,1.08,;-6.1,-2.01,;-6.5,-3.52,;-7.99,-3.12,;-7.58,-1.61,)|
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 450n/an/an/an/a


TBA



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


(Homo sapiens (Human))
BDBM50615783
PNG
(CHEMBL5284347)
Show SMILES C[C@@]1(O)C[C@@H](C1)NC(=O)c1cnc2cc(ncc2c1)N1CCC1 |r,wU:4.6,1.1,(7.22,3.52,;6.45,2.19,;7.99,2.19,;4.96,2.58,;4.55,1.07,;6.04,.67,;3.22,.3,;1.89,1.07,;1.89,2.61,;.55,.3,;.55,-1.24,;-.78,-2,;-2.11,-1.23,;-3.43,-2,;-4.76,-1.24,;-4.76,.29,;-3.45,1.06,;-2.11,.3,;-.79,1.08,;-6.1,-2.01,;-6.5,-3.52,;-7.99,-3.12,;-7.58,-1.61,)|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 56n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair