BDBM50002453 10-Ethyl-1-[2-(3-ethyl-3H-benzooxazol-2-ylidene)-ethylidene]-1,2,3,10-tetrahydro-10-aza-3a-azonia-pentaleno[1,2-b]naphthalene; iodide::CHEMBL23533

SMILES: CCN1\C(Oc2ccccc12)=C/C=C1CC[n+]2c1n(CC)c1cc3ccccc3cc21

InChI Key: InChIKey=MXTFAWQQCGBPDI-UHFFFAOYSA-N

Data: 1 IC50

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 = 50002453   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Substance-P receptor (Rattus norvegicus (rat))	BDBM50002453 (10-Ethyl-1-[2-(3-ethyl-3H-benzooxazol-2-ylidene)-e...) Show SMILES CCN1\C(Oc2ccccc12)=C/C=C1CC[n+]2c1n(CC)c1cc3ccccc3cc21 Show InChI InChI=1S/C27H26N3O/c1-3-28-22-11-7-8-12-25(22)31-26(28)14-13-19-15-16-30-24-18-21-10-6-5-9-20(21)17-23(24)29(4-2)27(19)30/h5-14,17-18H,3-4,15-16H2,1-2H3/q+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Rochester Curated by ChEMBL					Assay Description Inhibition of Tachykinin receptor 1 of rat forebrain tissue				J Med Chem 35: 1273-9 (1992) BindingDB Entry DOI: 10.7270/Q2222SQM
					More data for this Ligand-Target Pair