BDBM82271 CAS_260803::NAS::NSC_260803

SMILES: CC(=O)n1cc(CCN)c2cc(O)ccc12

InChI Key: InChIKey=AZRQSPSPOGVDRQ-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 82271   

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 (Sheep)	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by PDSP Ki Database									Neuron 13: 1177-85 (1994) Article DOI: 10.1016/0896-6273(94)90055-8 BindingDB Entry DOI: 10.7270/Q27P8WXK
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by PDSP Ki Database									Neuron 13: 1177-85 (1994) Article DOI: 10.1016/0896-6273(94)90055-8 BindingDB Entry DOI: 10.7270/Q27P8WXK
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	484	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; degli Studi di Milano Curated by PDSP Ki Database									Br J Pharmacol 124: 485-92 (1998) Article DOI: 10.1038/sj.bjp.0701860 BindingDB Entry DOI: 10.7270/Q29885KW
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi di Milano Curated by PDSP Ki Database									J Med Chem 41: 3624-34 (1998) Article DOI: 10.1021/jm970721h BindingDB Entry DOI: 10.7270/Q2T43RN6
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	595	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by PDSP Ki Database									Proc Natl Acad Sci U S A 92: 8734-8 (1995) Article DOI: 10.1073/pnas.92.19.8734 BindingDB Entry DOI: 10.7270/Q2GH9GGM
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM82271 (CAS_260803 | NAS | NSC_260803) Show SMILES CC(=O)n1cc(CCN)c2cc(O)ccc12 Show InChI InChI=1S/C12H14N2O2/c1-8(15)14-7-9(4-5-13)11-6-10(16)2-3-12(11)14/h2-3,6-7,16H,4-5,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	986	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by PDSP Ki Database									Proc Natl Acad Sci U S A 92: 8734-8 (1995) Article DOI: 10.1073/pnas.92.19.8734 BindingDB Entry DOI: 10.7270/Q2GH9GGM
					More data for this Ligand-Target Pair