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Triphosphate

Triphosphate

SCHEMBL10475447

CCC(OCCO)n1cc(C)c(=O)[nH]c1=O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 4/20 0.43
▸ POLB P06746 3/20 0.38
▸ POLA1 P09884 1/20 0.38
▸ POLD1 P28340 1/20 0.38
▸ TK1 P04183 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL10474572 0.89 TYMP (0.42) TYMPPOLBTK1ALDH1A1LMNA
Triphosphate SCHEMBL10475441 0.86 TYMP (0.46) TYMPPOLBPOLA1POLD1TK1
Triphosphate SCHEMBL10475689 0.81 TYMP (0.40) TYMPPOLBPOLA1POLD1TK1
SCHEMBL16038197 0.80 TYMP (0.60) TYMPTK1
SCHEMBL1902451 0.80 TYMP (0.42) TYMPPOLBTK1ALDH1A1LMNA
SCHEMBL12748530 0.80 TYMP (0.42) TYMPPOLBTK1ALDH1A1LMNA
SCHEMBL6555940 0.80 TYMP (0.42) TYMPPOLBTK1ALDH1A1LMNA
SCHEMBL23805468 0.79 TYMP (0.43) TYMPPOLBPOLA1POLD1TK1
SCHEMBL16299256 0.79 POLB (0.43) TYMPPOLBPOLA1POLD1TK1
Triphosphate SCHEMBL10475692 0.79 TYMP (0.39) TYMPPOLBPOLA1POLD1TK1

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.

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