null

SMILES: CC(C)CCCN1[C@@H](CCCCN2C[C@@H](CC3CCCCC3)N(CC3CCC(CC3)C(C)(C)C)C2=N)CN=C1N

InChI Key: InChIKey=NBDDRLZYBYKBNQ-UFADHCMUSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50446488   

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
Neuronal acetylcholine receptor subunit alpha-3/beta-4 (Rattus norvegicus (Rat))	BDBM50446488 (CHEMBL3110036) Show SMILES CC(C)CCCN1[C@@H](CCCCN2C[C@@H](CC3CCCCC3)N(CC3CCC(CC3)C(C)(C)C)C2=N)CN=C1N |r,wU:7.7,wD:14.14,c:40,(29.06,-42.63,;27.52,-42.56,;26.81,-41.19,;26.69,-43.85,;27.4,-45.22,;26.56,-46.52,;27.27,-47.88,;28.74,-48.34,;30.08,-47.59,;31.4,-48.38,;32.75,-47.62,;34.08,-48.4,;35.41,-47.65,;36.89,-48.1,;37.77,-46.84,;39.31,-46.82,;40.06,-45.47,;41.6,-45.46,;42.35,-44.12,;41.57,-42.8,;40.03,-42.82,;39.27,-44.16,;36.85,-45.61,;37.52,-44.22,;36.7,-42.92,;37.42,-41.57,;36.6,-40.27,;35.06,-40.33,;34.35,-41.69,;35.17,-43,;34.24,-39.03,;34.96,-37.67,;32.7,-39.09,;33.46,-37.68,;35.39,-46.11,;34.13,-45.22,;28.75,-49.88,;27.29,-50.38,;26.38,-49.14,;24.84,-49.15,)| Show InChI InChI=1S/C34H64N6/c1-26(2)12-11-21-39-30(23-37-32(39)35)15-9-10-20-38-25-31(22-27-13-7-6-8-14-27)40(33(38)36)24-28-16-18-29(19-17-28)34(3,4)5/h26-31,36H,6-25H2,1-5H3,(H2,35,37)/t28?,29?,30-,31+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.84E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from rat alpha3beta4 nAChR transfected in HEK293 cells after 2 hrs by beta-plate counting analysis				J Med Chem 56: 10103-17 (2013) Article DOI: 10.1021/jm401543h BindingDB Entry DOI: 10.7270/Q25D8TBR
					More data for this Ligand-Target Pair