SCHEMBL21187166 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	MET	P08581	7/20	0.37

▸	AXL	P30530	3/20	0.36

▸	PDE4B	Q07343	1/20	0.36

▸	PDE4D	Q08499	1/20	0.36

▸	CASP3	P42574	1/20	0.36

▸	CDK9	P50750	1/20	0.36

▸	CASP7	P55210	1/20	0.36

▸	MAP2K1	Q02750	1/20	0.35

▸	KDR	P35968	2/20	0.35

▸	PDGFRA	P16234	1/20	0.35

▸	SLC11A2	P49281	1/20	0.35

▸	CHRM4	P08173	1/20	0.35

▸	BRAF	P15056	1/20	0.35

▸	IDO1	P14902	1/20	0.34

▸	FGFR4	P22455	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
SCHEMBL21187168	0.85	GRM4 (0.41)	METPDE4BPDE4DCASP3CDK9
SCHEMBL21187153	0.82	NPC1 (0.45)	CASP3
SCHEMBL21187157	0.82	NPC1 (0.41)	IDO1
SCHEMBL21187138	0.79	IDO1 (0.50)	KDRPDGFRAIDO1
SCHEMBL21187131	0.79	IDO1 (0.50)	KDRPDGFRAIDO1
SCHEMBL21187158	0.79	PDE4B (0.37)	METAXLPDE4BPDE4DCASP3
SCHEMBL21187156	0.77	NPC1 (0.43)	CASP3
SCHEMBL21187221	0.75	IDO1 (0.39)	METIDO1
SCHEMBL21187145	0.71	FPR2 (0.39)	—
SCHEMBL21187159	0.69	IDO1 (0.37)	METKDRPDGFRAIDO1

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-2019141095-A1	AMIDINE AND GUANIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF	四川科伦博泰生物医药股份有限公司	2019-07-25	—	—	WO	disclosed