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BDBM50037768 5-[2-Imidazol-1-yl-1,3-diphenyl-prop-(E)-ylideneaminooxy]-3,3-dimethyl-pentanoic acid::CHEMBL123307

SMILES: CC(C)(CCO\N=C(\C(Cc1ccccc1)n1ccnc1)c1ccccc1)CC(O)=O

InChI Key: InChIKey=CVNWEPXFYHLRCJ-SOYKGTTHSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50037768   
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
Thromboxane-A synthase


(Rattus norvegicus)
BDBM50037768
PNG
(5-[2-Imidazol-1-yl-1,3-diphenyl-prop-(E)-ylideneam...)
Show SMILES CC(C)(CCO\N=C(\C(Cc1ccccc1)n1ccnc1)c1ccccc1)CC(O)=O
Show InChI InChI=1S/C25H29N3O3/c1-25(2,18-23(29)30)13-16-31-27-24(21-11-7-4-8-12-21)22(28-15-14-26-19-28)17-20-9-5-3-6-10-20/h3-12,14-15,19,22H,13,16-18H2,1-2H3,(H,29,30)/b27-24+
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 530n/an/an/an/an/an/a



Pharmacia-Farmitalia Carlo Erba

Curated by ChEMBL


Assay Description
In vitro inhibition of thromboxane-A2 synthase in rat whole blood during clotting at 37 degrees centigrade


J Med Chem 37: 3588-604 (1994)


BindingDB Entry DOI: 10.7270/Q2C24VFD
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50037768
PNG
(5-[2-Imidazol-1-yl-1,3-diphenyl-prop-(E)-ylideneam...)
Show SMILES CC(C)(CCO\N=C(\C(Cc1ccccc1)n1ccnc1)c1ccccc1)CC(O)=O
Show InChI InChI=1S/C25H29N3O3/c1-25(2,18-23(29)30)13-16-31-27-24(21-11-7-4-8-12-21)22(28-15-14-26-19-28)17-20-9-5-3-6-10-20/h3-12,14-15,19,22H,13,16-18H2,1-2H3,(H,29,30)/b27-24+
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 230n/an/an/an/an/an/a



Pharmacia-Farmitalia Carlo Erba

Curated by ChEMBL


Assay Description
In vitro thromboxane-A2 receptor binding affinity to displace by 50% [3H]-SQ 29548 binding from washed human platelets


J Med Chem 37: 3588-604 (1994)


BindingDB Entry DOI: 10.7270/Q2C24VFD
More data for this
Ligand-Target Pair