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BDBM50192936 4-(3-cyclohexylureido)butanoic acid::4-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACID::CHEMBL219695

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

InChI Key: InChIKey=WSVFRGGLURJIMG-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50192936   
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50192936
PNG
(4-(3-cyclohexylureido)butanoic acid | 4-{[(CYCLOHE...)
Show SMILES OC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C11H20N2O3/c14-10(15)7-4-8-12-11(16)13-9-5-2-1-3-6-9/h9H,1-8H2,(H,14,15)(H2,12,13,16)
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 3.60E+4n/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))
BDBM50192936
PNG
(4-(3-cyclohexylureido)butanoic acid | 4-{[(CYCLOHE...)
Show SMILES OC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C11H20N2O3/c14-10(15)7-4-8-12-11(16)13-9-5-2-1-3-6-9/h9H,1-8H2,(H,14,15)(H2,12,13,16)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.90E+3n/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