Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 363.4 BDBM50580010

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

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
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM50580010 (CHEMBL5085622 | US20230357269, Example 69) Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4ccc(C5CC5)c(CO1)c4)c3c2 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM50580010 (CHEMBL5085622 | US20230357269, Example 69) Show SMILES O=C1NCCCOc2ccc3[nH]nc(-c4ccc(C5CC5)c(CO1)c4)c3c2 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human LRRK2 using LRRKtide peptide and ATP as substrates incubated for 1 hrs by ADP-glo luminescent assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00687 BindingDB Entry DOI: 10.7270/Q2NK3JWS
					More data for this Ligand-Target Pair