SCHEMBL8253707 — predicted protein targets

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	ADRB3	P13945	1/20	0.32

▸	ADRA2B	P18089	1/20	0.32

▸	ADRA2C	P18825	1/20	0.32

▸	LMNA	P02545	1/20	0.31

▸	CYP1A2	P05177	1/20	0.31

▸	CYP3A4	P08684	1/20	0.31

▸	MAOA	P21397	1/20	0.31

▸	CTSB	P07858	1/20	0.30

▸	ALDH1A1	P00352	1/20	0.30

▸	ESR1	P03372	1/20	0.30

▸	HSD17B10	Q99714	1/20	0.30

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
SCHEMBL2843889	0.90	POLB (0.37)	ADRB3ADRA2BADRA2CALDH1A1
SCHEMBL6760115	0.90	POLB (0.37)	ADRB3ADRA2BADRA2CALDH1A1
SCHEMBL8238400	0.90	POLB (0.37)	ADRB3ADRA2BADRA2CALDH1A1
SCHEMBL2843887	0.90	POLB (0.37)	ADRB3ADRA2BADRA2CALDH1A1
SCHEMBL14020643	0.88	POLB (0.38)	ADRB3ADRA2BADRA2CALDH1A1
SCHEMBL6760157	0.83	CTSB (0.31)	CTSB
SCHEMBL2837626	0.83	CTSB (0.31)	CTSB
SCHEMBL2837629	0.83	CTSB (0.31)	CTSB
SCHEMBL8245129	0.83	CTSB (0.31)	CTSB
SCHEMBL14020644	0.81	—	—

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
WO-2007014918-A1	MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS	TIBOTEC PHARMACEUTICALS LTD. (IE)	2007-02-08	—	—	WO	disclosed