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BDBM22901 1-cyclohexyl-3-[5-(1H-imidazol-4-yl)pentyl]thiourea::VUF 4617

SMILES: S=C(NCCCCCc1cnc[nH]1)NC1CCCCC1

InChI Key: InChIKey=KUPSNGBUPNAIBJ-UHFFFAOYSA-N

Data: 1 KI  1 Kd

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 22901   
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
Histamine H4 receptor


(Homo sapiens (Human))
BDBM22901
PNG
(1-cyclohexyl-3-[5-(1H-imidazol-4-yl)pentyl]thioure...)
Show SMILES S=C(NCCCCCc1cnc[nH]1)NC1CCCCC1
Show InChI InChI=1S/C15H26N4S/c20-15(19-13-7-3-1-4-8-13)17-10-6-2-5-9-14-11-16-12-18-14/h11-13H,1-10H2,(H,16,18)(H2,17,19,20)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
13n/an/an/an/an/an/an/an/a



Vrije Universiteit Amsterdam



Assay Description
Ligand displacement assays were performed on The SK-N-MC/hH4R cell homogenates. Retained radioactivity was determined by liquid scintillation countin...


J Pharmacol Exp Ther 314: 1310-21 (2005)


Article DOI: 10.1124/jpet.105.087965
BindingDB Entry DOI: 10.7270/Q2KD1W6V
More data for this
Ligand-Target Pair
HRH3


(GUINEA PIG)
BDBM22901
PNG
(1-cyclohexyl-3-[5-(1H-imidazol-4-yl)pentyl]thioure...)
Show SMILES S=C(NCCCCCc1cnc[nH]1)NC1CCCCC1
Show InChI InChI=1S/C15H26N4S/c20-15(19-13-7-3-1-4-8-13)17-10-6-2-5-9-14-11-16-12-18-14/h11-13H,1-10H2,(H,16,18)(H2,17,19,20)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/an/a 31.6n/an/an/an/an/a



Vrije Universiteit Amsterdam

Curated by ChEMBL


Assay Description
In vitro inhibitory effect of histamine H3 antagonist on the electrically evoked contractile response of isolated guinea pig jejunum segments.


J Med Chem 38: 2244-50 (1995)


BindingDB Entry DOI: 10.7270/Q2RF5W7Q
More data for this
Ligand-Target Pair