Kahn, I.; Lomaka, A.; Karelson, M. Topological Fingerprints as an Aid in Finding Structural Patterns for LRRK2 Inhibition. Mol. Inf. 2014, 33, 269-275.

Compound

	ID:	CHEMBL1976872
	Name:	N-pyrazolo[1,5-a]pyridin-2-ylacetamide
	Description:
	Labels:	Training
	CAS:
	InChi Code:	InChI=1S/C9H9N3O/c1-7(13)10-9-6-8-4-2-3-5-12(8)11-9/h2-6H,1H3,(H,10,11,13)

Properties

pKi: LRRK2 inhibition as log(1/Ki)

Value	Source or prediction
4.6	experimental value
4.754151	pls: PLS model of diverse drug-like compounds (Training set)
5.221142	bmlr: MLR model of diverse drug-like compounds (Training set)