SCHEMBL19027757 — predicted protein targets

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	ALK	Q9UM73	14/20	0.62

▸	INSR	P06213	13/20	0.62

▸	IGF1R	P08069	13/20	0.62

▸	EGFR	P00533	8/20	0.58

▸	MET	P08581	3/20	0.58

▸	CHEK1	O14757	2/20	0.58

▸	AURKA	O14965	2/20	0.58

▸	NUAK1	O60285	2/20	0.58

▸	JAK2	O60674	2/20	0.58

▸	STK10	O94804	2/20	0.58

▸	PRKD3	O94806	2/20	0.58

▸	CHEK2	O96017	2/20	0.58

▸	ABL1	P00519	2/20	0.58

▸	ERBB2	P04626	2/20	0.58

▸	LCK	P06239	2/20	0.58

▸	FYN	P06241	2/20	0.58

▸	FES	P07332	2/20	0.58

▸	CSF1R	P07333	2/20	0.58

▸	YES1	P07947	2/20	0.58

▸	LYN	P07948	2/20	0.58

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
SCHEMBL28479268	0.89	ALK (0.79)	ALKINSRIGF1REGFRMET
SCHEMBL24178921	0.80	INSR (0.60)	ALKINSRIGF1REGFRMET
SCHEMBL22806779	0.79	EGFR (0.77)	ALKINSRIGF1REGFRMET
SCHEMBL29624221	0.79	EGFR (0.77)	ALKINSRIGF1REGFRMET
SCHEMBL21235197	0.79	ALK (0.73)	ALKINSRIGF1REGFRMET
SCHEMBL24178920	0.79	INSR (0.74)	ALKINSRIGF1REGFRMET
SCHEMBL27360981	0.77	ALK (0.77)	ALKINSRIGF1REGFRMET
SCHEMBL26906637	0.77	EGFR (0.82)	ALKINSRIGF1REGFRMET
SCHEMBL19027378	0.77	EGFR (0.62)	ALKIGF1REGFRMAPK3
SCHEMBL15217790	0.77	INSR (1.00)	ALKINSRIGF1REGFRMET

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-2017101803-A1	NOVEL EGFR AND ALK DUAL INHIBITOR	合肥中科普瑞昇生物医药科技有限公司	2017-06-22	—	—	WO	disclosed