Triphosphate

SCHEMBL10475441

Cc1cn(C(C)OCCO)c(=O)[nH]c1=O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	TYMP	P19971	4/20	0.46

▸	SMN1; SMN2	Q16637	1/20	0.44

▸	POLB	P06746	3/20	0.39

▸	POLA1	P09884	1/20	0.39

▸	POLD1	P28340	1/20	0.39

▸	TK1	P04183	3/20	0.36

▸	ALDH1A1	P00352	1/20	0.34

▸	LMNA	P02545	1/20	0.34

▸	ALB	P02768	1/20	0.34

▸	ADRA1A	P35348	1/20	0.34

▸	BLM	P54132	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
SCHEMBL10474801	0.89	SMN1; SMN2 (0.52)	TYMPSMN1; SMN2POLBTK1ALDH1A1
Triphosphate SCHEMBL10475447	0.86	TYMP (0.43)	TYMPSMN1; SMN2POLBPOLA1POLD1
Triphosphate SCHEMBL10475689	0.83	TYMP (0.40)	TYMPPOLBPOLA1POLD1TK1
Triphosphate SCHEMBL10475692	0.80	TYMP (0.39)	TYMPPOLBPOLA1POLD1TK1
Triphosphate SCHEMBL10474748	0.80	TYMP (0.38)	TYMPPOLBPOLA1POLD1TK1
SCHEMBL17986375	0.78	TYMP (0.45)	TYMPSMN1; SMN2POLBTK1
Triphosphate SCHEMBL10474869	0.75	TYMP (0.55)	TYMPPOLBPOLA1POLD1TK1
SCHEMBL11098893	0.75	SMN1; SMN2 (0.73)	SMN1; SMN2POLBLMNA
SCHEMBL8780709	0.74	SMN1; SMN2 (0.48)	TYMPSMN1; SMN2TK1ALDH1A1
SCHEMBL12748530	0.74	TYMP (0.42)	TYMPSMN1; SMN2POLBTK1ALDH1A1

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-1990009999-A1	SECO-NUCLEOSIDE DERIVATIVES AND DRUGS CONTAINING THEM	BOEHRINGER MANNHEIM GMBH (DE)	1990-09-07	—	—	WO	disclosed