BindingDB logo
myBDB logout

null

SMILES: Clc1cncc(Cl)c1N=NCc1ccccc1-c1ccccc1

InChI Key: InChIKey=XTJWKLBABUHLSD-UHFFFAOYSA-N

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 1 hit for monomerid = 50178563   
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
Substance-P receptor


(Homo sapiens (Human))		BDBM50178563
PNG
(CHEMBL383289 | N-[1-biphenyl-2-yl-methylidene]-N'-...)
Show SMILES Clc1cncc(Cl)c1N=NCc1ccccc1-c1ccccc1 |w:9.10|
Show InChI InChI=1S/C18H13Cl2N3/c19-16-11-21-12-17(20)18(16)23-22-10-14-8-4-5-9-15(14)13-6-2-1-3-7-13/h1-9,11-12H,10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 933n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]-labeled substance P from cloned human NK1 receptor expressed in CHO cells

Bioorg Med Chem Lett 16: 1362-5 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.047
BindingDB Entry DOI: 10.7270/Q2D50MJP
More data for this
Ligand-Target Pair