SCHEMBL4043196 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CTSK	P43235	8/20	0.39

▸	CTSL	P07711	5/20	0.35

▸	CTSS	P25774	3/20	0.35

▸	CTSB	P07858	2/20	0.35

▸	SMYD3	Q9H7B4	2/20	0.35

▸	ALDH1A1	P00352	1/20	0.35

▸	MAPT	P10636	1/20	0.34

▸	TSHR	P16473	1/20	0.34

▸	FKBP1A	P62942	1/20	0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL4050153	0.92	SMYD3 (0.35)	SMYD3ALDH1A1MAPTTSHRFKBP1A
SCHEMBL4045303	0.89	CTSK (0.37)	CTSKCTSLCTSSCTSBSMYD3
SCHEMBL4049190	0.89	CTSK (0.40)	CTSKCTSLCTSSCTSB
SCHEMBL4042764	0.89	CTSK (0.38)	CTSKCTSLCTSSCTSBSMYD3
SCHEMBL4044003	0.88	CTSK (0.40)	CTSKCTSLCTSSCTSBFKBP1A
SCHEMBL4042904	0.88	CTSK (0.39)	CTSKCTSLCTSSCTSBSMYD3
SCHEMBL4043952	0.87	CTSK (0.42)	CTSKCTSLCTSSCTSBFKBP1A
SCHEMBL4049412	0.87	CTSK (0.42)	CTSKCTSLCTSSCTSBALDH1A1
SCHEMBL4044807	0.87	CTSK (0.39)	CTSKCTSLCTSSCTSBSMYD3
SCHEMBL4046882	0.86	CTSK (0.41)	CTSKCTSLCTSSCTSBALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-1546150-B1	PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES	AMURA THERAPEUTICS LTD (GB)	2009-03-04	—	—	EP	claimed