BDBM21364 3-[(E)-[(5-bromo-1H-indol-3-yl)methylidene]amino]guanidine::5-bromoindole aminoguanidine, 6

SMILES: NC(N)=NN=Cc1c[nH]c2ccc(Br)cc12

InChI Key: InChIKey=FENBNNFSZUQLQX-UHFFFAOYSA-N

Data: 1 KI

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 = 21364   

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
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM21364 (3-[(E)-[(5-bromo-1H-indol-3-yl)methylidene]amino]g...) Show SMILES NC(N)=NN=Cc1c[nH]c2ccc(Br)cc12 |w:5.5,(2.73,6.82,;1.96,8.16,;2.73,9.49,;.42,8.16,;-.35,6.82,;-1.86,6.5,;-2.34,5.04,;-1.43,3.79,;-2.34,2.55,;-3.8,3.02,;-5.13,2.25,;-6.47,3.02,;-6.47,4.56,;-7.8,5.33,;-5.13,5.33,;-3.8,4.56,)| Show InChI InChI=1S/C10H10BrN5/c11-7-1-2-9-8(3-7)6(4-14-9)5-15-16-10(12)13/h1-5,14H,(H4,12,13,16)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	-10.3	n/a	n/a	n/a	n/a	n/a	7.4	22
Wyeth Research					Assay Description IC50 values for each test compound were determined from nonlinear regression analysis of data collected from ligand binding experiments. The inhibiti...				J Med Chem 50: 5535-8 (2007) Article DOI: 10.1021/jm070521y BindingDB Entry DOI: 10.7270/Q23R0R5G
					More data for this Ligand-Target Pair