SCHEMBL28694530 — predicted protein targets

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	KDR	P35968	18/20	0.60

▸	HDAC3	O15379	14/20	0.60

▸	HDAC4	P56524	14/20	0.60

▸	HDAC1	Q13547	14/20	0.60

▸	HDAC7	Q8WUI4	14/20	0.60

▸	HDAC2	Q92769	14/20	0.60

▸	HDAC10	Q969S8	14/20	0.60

▸	HDAC11	Q96DB2	14/20	0.60

▸	HDAC8	Q9BY41	14/20	0.60

▸	HDAC6	Q9UBN7	14/20	0.60

▸	HDAC9	Q9UKV0	14/20	0.60

▸	HDAC5	Q9UQL6	14/20	0.60

▸	EGFR	P00533	7/20	0.56

▸	ERBB2	P04626	1/20	0.55

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
SCHEMBL29449675	1.00	KDR (0.60)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449663	1.00	KDR (0.60)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449689	0.90	EGFR (0.61)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449698	0.90	EGFR (0.61)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449699	0.90	EGFR (0.61)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449688	0.89	KDR (0.57)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449706	0.89	KDR (0.57)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL29449652	0.89	KDR (0.57)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL28985104	0.88	KDR (0.56)	KDRHDAC3HDAC4HDAC1HDAC7
SCHEMBL28699429	0.88	KDR (0.58)	KDRHDAC3HDAC4HDAC1HDAC7

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
CN-109942499-B	Quinazoline derivative and preparation method and application thereof	湖南中医药大学	2022-03-22	—	—	CN	disclosed