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BDBM50143914 (3-Cyclohexyl-ureido)-acetic acid::2-(3-cyclohexylureido)acetic acid::CHEMBL66380::N-[(CYCLOHEXYLAMINO)CARBONYL]GLYCINE

SMILES: OC(=O)CNC(=O)NC1CCCCC1

InChI Key: InChIKey=NVORCMBCUHQRDL-UHFFFAOYSA-N

Data: 4 IC50

PDB links: 1 PDB ID matches this monomer.

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 4 hits for monomerid = 50143914   
Target
(Institution)
LigandTarget
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
PDB

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against mouse soluble epoxide hydrolase (sEH)


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
PDB

SMPDB pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
PDB
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble Epoxide hydrolase


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant soluble Epoxide hydrolase


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
PDB

SMPDB pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
PDB
Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against human soluble epoxide hydrolase (sEH)


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)