SCHEMBL5796729 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	LMNA	P02545	2/20	0.39

▸	ELANE	P08246	1/20	0.36

▸	ALDH1A1	P00352	3/20	0.35

▸	PTGS2	P35354	5/20	0.35

▸	TSHR	P16473	2/20	0.33

▸	ADRB2	P07550	1/20	0.33

▸	ADRB1	P08588	1/20	0.33

▸	ADRB3	P13945	1/20	0.33

▸	KMT2A	Q03164	1/20	0.33

▸	AKR1C3	P42330	1/20	0.33

▸	AKR1C2	P52895	1/20	0.33

▸	ESR1	P03372	1/20	0.33

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
SCHEMBL5796727	1.00	LMNA (0.39)	LMNAELANEALDH1A1PTGS2TSHR
SCHEMBL5801301	0.92	PTGS2 (0.38)	ELANEALDH1A1PTGS2KMT2AESR1
SCHEMBL5801297	0.92	PTGS2 (0.38)	ELANEALDH1A1PTGS2KMT2AESR1
SCHEMBL5796759	0.89	PTGS2 (0.39)	ALDH1A1PTGS2ESR1
SCHEMBL5796756	0.89	PTGS2 (0.39)	ALDH1A1PTGS2ESR1
SCHEMBL5798594	0.89	LMNA (0.39)	LMNAELANEALDH1A1PTGS2TSHR
SCHEMBL5813384	0.88	PTGS2 (0.38)	ALDH1A1PTGS2TSHRESR1
SCHEMBL5801013	0.88	ESR1 (0.38)	PTGS2TSHRESR1
SCHEMBL5801009	0.88	ESR1 (0.38)	PTGS2TSHRESR1
SCHEMBL5813388	0.88	PTGS2 (0.38)	ALDH1A1PTGS2TSHRESR1

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-2006050120-A2	SYNTHESIS OF COX-2 AND FAAH INHIBITORS	MICROBIA, INC. (US)	2006-05-11	—	—	WO	disclosed