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SMILES: COc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1

InChI Key: InChIKey=NPUHZBJVAWACGT-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 458540   

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 1A (Homo sapiens (Human))	BDBM458540 (US10745401, Example 14) Show SMILES COc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1 Show InChI InChI=1S/C23H26N4O3/c1-29-21-14-17-8-11-27(23(28)19(17)15-24-21)13-12-26-9-6-16(7-10-26)22-18-4-2-3-5-20(18)30-25-22/h2-5,14-16H,6-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description Binding affinity of the present compound for human 5-HT1A receptor, human 5-HT2A receptor, and human D2 receptor was measured by the following proced...				US Patent US10745401 (2020)
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM458540 (US10745401, Example 14) Show SMILES COc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1 Show InChI InChI=1S/C23H26N4O3/c1-29-21-14-17-8-11-27(23(28)19(17)15-24-21)13-12-26-9-6-16(7-10-26)22-18-4-2-3-5-20(18)30-25-22/h2-5,14-16H,6-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description Binding affinity of the present compound for human 5-HT1A receptor, human 5-HT2A receptor, and human D2 receptor was measured by the following proced...				US Patent US10745401 (2020)
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM458540 (US10745401, Example 14) Show SMILES COc1cc2CCN(CCN3CCC(CC3)c3noc4ccccc34)C(=O)c2cn1 Show InChI InChI=1S/C23H26N4O3/c1-29-21-14-17-8-11-27(23(28)19(17)15-24-21)13-12-26-9-6-16(7-10-26)22-18-4-2-3-5-20(18)30-25-22/h2-5,14-16H,6-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	136	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description Binding affinity of the present compound for human 5-HT1A receptor, human 5-HT2A receptor, and human D2 receptor was measured by the following proced...				US Patent US10745401 (2020)
					More data for this Ligand-Target Pair