Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Amyloid-beta precursor protein' and Ligand = 'BDBM50598554'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50598554 (CHEMBL5208480) Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OCC(=O)NCCC(=O)NCCC(=O)NCCCCCCn1cc(C\C(=C(\O)/C=C/c2ccc(O)c(OC)c2)C(=O)\C=C\c2ccc(O)c(OC)c2)nn1)[C@@H](C)CCCC(C)C |r,t:9| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.03E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01619 BindingDB Entry DOI: 10.7270/Q2X92GCK
					More data for this Ligand-Target Pair
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50598554 (CHEMBL5208480) Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OCC(=O)NCCC(=O)NCCC(=O)NCCCCCCn1cc(C\C(=C(\O)/C=C/c2ccc(O)c(OC)c2)C(=O)\C=C\c2ccc(O)c(OC)c2)nn1)[C@@H](C)CCCC(C)C |r,t:9| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01619 BindingDB Entry DOI: 10.7270/Q2X92GCK
					More data for this Ligand-Target Pair
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50598554 (CHEMBL5208480) Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OCC(=O)NCCC(=O)NCCC(=O)NCCCCCCn1cc(C\C(=C(\O)/C=C/c2ccc(O)c(OC)c2)C(=O)\C=C\c2ccc(O)c(OC)c2)nn1)[C@@H](C)CCCC(C)C |r,t:9| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.17E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01619 BindingDB Entry DOI: 10.7270/Q2X92GCK
					More data for this Ligand-Target Pair