null

SMILES: O=C(N[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1)c1ccccc1

InChI Key: InChIKey=FZJKKJISIIXCAF-UIOOFZCWSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50029889   

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
Substance-P receptor (Homo sapiens (Human))	BDBM50029889 (CHEMBL281502 | N-((2S,3S)-2-Benzhydryl-1-aza-bicyc...) Show SMILES O=C(N[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1)c1ccccc1 |wD:3.2,10.12,(5.99,.93,;4.66,.16,;4.65,-1.39,;3.3,-2.16,;1.97,-1.38,;.65,-2.16,;.65,-3.7,;1.97,-4.47,;2.53,-3.48,;1.2,-2.71,;3.3,-3.7,;4.65,-4.47,;5.99,-3.7,;5.99,-2.16,;7.32,-1.39,;8.66,-2.16,;8.66,-3.7,;7.32,-4.47,;4.64,-6.02,;5.97,-6.78,;5.99,-8.31,;4.64,-9.1,;3.3,-8.31,;3.3,-6.78,;3.32,.93,;3.33,2.48,;2,3.25,;.66,2.49,;.66,.94,;2,.16,)| Show InChI InChI=1S/C27H28N2O/c30-27(23-14-8-3-9-15-23)28-25-22-16-18-29(19-17-22)26(25)24(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,22,24-26H,16-19H2,(H,28,30)/t25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [125]Substance P Binding from human Neurokinin NK1 receptor in CHO Cells				Bioorg Med Chem Lett 3: 1361-1366 (1993) Article DOI: 10.1016/S0960-894X(00)80349-2 BindingDB Entry DOI: 10.7270/Q2251J4R
					More data for this Ligand-Target Pair
Substance-P receptor (Homo sapiens (Human))	BDBM50029889 (CHEMBL281502 | N-((2S,3S)-2-Benzhydryl-1-aza-bicyc...) Show SMILES O=C(N[C@H]1C2CCN(CC2)[C@H]1C(c1ccccc1)c1ccccc1)c1ccccc1 |wD:3.2,10.12,(5.99,.93,;4.66,.16,;4.65,-1.39,;3.3,-2.16,;1.97,-1.38,;.65,-2.16,;.65,-3.7,;1.97,-4.47,;2.53,-3.48,;1.2,-2.71,;3.3,-3.7,;4.65,-4.47,;5.99,-3.7,;5.99,-2.16,;7.32,-1.39,;8.66,-2.16,;8.66,-3.7,;7.32,-4.47,;4.64,-6.02,;5.97,-6.78,;5.99,-8.31,;4.64,-9.1,;3.3,-8.31,;3.3,-6.78,;3.32,.93,;3.33,2.48,;2,3.25,;.66,2.49,;.66,.94,;2,.16,)| Show InChI InChI=1S/C27H28N2O/c30-27(23-14-8-3-9-15-23)28-25-22-16-18-29(19-17-22)26(25)24(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,22,24-26H,16-19H2,(H,28,30)/t25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-SP to the CHO cell line expressing human Tachykinin receptor 1				J Med Chem 38: 4793-805 (1996) BindingDB Entry DOI: 10.7270/Q2PG1QRK
					More data for this Ligand-Target Pair