BDBM50093278 CHEMBL130319::N-(2,3-Dihydro-1H-phenalen-1-ylmethyl)-acetamide

SMILES: CC(=O)NCC1CCc2cccc3cccc1c23

InChI Key: InChIKey=YEJNNHSHBRFGLW-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 = 50093278   

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
Melatonin receptor (Homo sapiens (Human))	BDBM50093278 (CHEMBL130319 | N-(2,3-Dihydro-1H-phenalen-1-ylmeth...) Show SMILES CC(=O)NCC1CCc2cccc3cccc1c23 Show InChI InChI=1S/C16H17NO/c1-11(18)17-10-14-9-8-13-5-2-4-12-6-3-7-15(14)16(12)13/h2-7,14H,8-10H2,1H3,(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université de Paris-Sud Curated by ChEMBL					Assay Description Binding affinity for melatonin receptor type 1B, expressed in HEK-293 cells (2-[125I]-Iodomelatonin is used as radioligand)				J Med Chem 43: 4051-62 (2000) BindingDB Entry DOI: 10.7270/Q20Z72JX
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50093278 (CHEMBL130319 | N-(2,3-Dihydro-1H-phenalen-1-ylmeth...) Show SMILES CC(=O)NCC1CCc2cccc3cccc1c23 Show InChI InChI=1S/C16H17NO/c1-11(18)17-10-14-9-8-13-5-2-4-12-6-3-7-15(14)16(12)13/h2-7,14H,8-10H2,1H3,(H,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université de Paris-Sud Curated by ChEMBL					Assay Description Binding affinity for human melatonin receptor type 1A, expressed in HEK-293 cells (2-[125I]-Iodomelatonin is used as radioligand)				J Med Chem 43: 4051-62 (2000) BindingDB Entry DOI: 10.7270/Q20Z72JX
					More data for this Ligand-Target Pair