BDBM50135734 1,7,9-Trimethyl-1,4,5,6-tetrahydro-8-thia-1,2-diaza-cyclopenta[e]azulene::CHEMBL316727

SMILES: Cc1sc(C)c-2c1CCCc1cnn(C)c-21

InChI Key: InChIKey=UJQOABPSKFUADC-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50135734   

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
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50135734 (1,7,9-Trimethyl-1,4,5,6-tetrahydro-8-thia-1,2-diaz...) Show SMILES Cc1sc(C)c-2c1CCCc1cnn(C)c-21 Show InChI InChI=1S/C13H16N2S/c1-8-11-6-4-5-10-7-14-15(3)13(10)12(11)9(2)16-8/h7H,4-6H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Binding affinity to recombinant human dopamine receptor D4				Bioorg Med Chem Lett 13: 2921-4 (2003) BindingDB Entry DOI: 10.7270/Q2NP23T5
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50135734 (1,7,9-Trimethyl-1,4,5,6-tetrahydro-8-thia-1,2-diaz...) Show SMILES Cc1sc(C)c-2c1CCCc1cnn(C)c-21 Show InChI InChI=1S/C13H16N2S/c1-8-11-6-4-5-10-7-14-15(3)13(10)12(11)9(2)16-8/h7H,4-6H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	176	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurogen Corporation Curated by ChEMBL					Assay Description Binding affinity of the compound towards cloned human Dopamine receptor D2 was determined				Bioorg Med Chem Lett 13: 2921-4 (2003) BindingDB Entry DOI: 10.7270/Q2NP23T5
					More data for this Ligand-Target Pair