null

SMILES: CC(=O)N1CCC(COc2ncc(cn2)-c2cccc(CCC(=O)CC(N)=N)c2F)CC1

InChI Key: InChIKey=HTZSQRISAYIVMZ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 228076   

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
Membrane primary amine oxidase (Rattus norvegicus (Rat))	BDBM228076 (US9556160, ex 105) Show SMILES CC(=O)N1CCC(COc2ncc(cn2)-c2cccc(CCC(=O)CC(N)=N)c2F)CC1 Show InChI InChI=1S/C23H28FN5O3/c1-15(30)29-9-7-16(8-10-29)14-32-23-27-12-18(13-28-23)20-4-2-3-17(22(20)24)5-6-19(31)11-21(25)26/h2-4,12-13,16H,5-11,14H2,1H3,(H3,25,26)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	25
Astellas Pharma Inc. US Patent					Assay Description A rat VAP-1 enzyme (SSAO) (reference: Biol Pharm Bull. 2005 March; 28(3): 413-8) activity was measured by a radiochemistry-enzymatic assay using 14C-...				US Patent US9556160 (2017) BindingDB Entry DOI: 10.7270/Q2KP845Q
					More data for this Ligand-Target Pair
Membrane primary amine oxidase (Homo sapiens (Human))	BDBM228076 (US9556160, ex 105) Show SMILES CC(=O)N1CCC(COc2ncc(cn2)-c2cccc(CCC(=O)CC(N)=N)c2F)CC1 Show InChI InChI=1S/C23H28FN5O3/c1-15(30)29-9-7-16(8-10-29)14-32-23-27-12-18(13-28-23)20-4-2-3-17(22(20)24)5-6-19(31)11-21(25)26/h2-4,12-13,16H,5-11,14H2,1H3,(H3,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	25
Astellas Pharma Inc. US Patent					Assay Description A human VAP-1 enzyme (SSAO) (reference: J Exp Med. 1998 Jul. 6; 188(1): 17 to 27) activity was measured by a radiochemistry-enzymatic assay using 14C...				US Patent US9556160 (2017) BindingDB Entry DOI: 10.7270/Q2KP845Q
					More data for this Ligand-Target Pair