SCHEMBL17859569 — predicted protein targets

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	NOS3	P29474	4/20	0.38

▸	NOS1	P29475	4/20	0.38

▸	HTR1A	P08908	1/20	0.34

▸	SLC6A4	P31645	1/20	0.34

▸	NPY5R	Q15761	3/20	0.33

▸	NOS2	P35228	3/20	0.32

▸	KCNH2	Q12809	1/20	0.32

▸	TSHR	P16473	1/20	0.31

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
SCHEMBL17859567	0.96	NOS3 (0.37)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17859578	0.91	HTR1A (0.38)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17859568	0.91	NOS3 (0.41)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17859565	0.90	NOS3 (0.40)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17525505	0.89	NOS3 (0.41)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17525506	0.89	NOS3 (0.40)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17525502	0.88	NOS3 (0.39)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17525492	0.88	NOS3 (0.38)	NOS3NOS1HTR1ASLC6A4NOS2
SCHEMBL17859571	0.87	HTR1A (0.39)	NOS3NOS1HTR1ASLC6A4NPY5R
SCHEMBL17525486	0.85	NOS3 (0.40)	NOS3NOS1HTR1ASLC6A4NPY5R

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-2016097023-A1	CATIONIC BENZOXAZINE DERIVATIVES AND USE IN HAIR DYEING	L'OREAL (FR)	2016-06-23	—	—	WO	disclosed