Triphosphate

Triphosphate

SCHEMBL8023890

N=C(N)N.N=C(N)N.N=C(N)N.N=C(N)N.N=C(N)N.O=P(O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2

The experimentally established mechanism targets of Triphosphate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA4 P22748 1/20 0.39
BTN3A1 O00481 3/20 0.37
MVD P53602 3/20 0.32
TPI1 P60174 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.

Compoundsimilaritytop predictedshared targets
Triphosphate SCHEMBL122712 1.00 FDPS (0.50) FDPSBLMTDP1CA4BTN3A1
Guanidine SCHEMBL32685203 0.97 FDPS (0.47) FDPSBLMTDP1CA4BTN3A1
Pyrophosphoric Acid SCHEMBL8993614 0.88 FDPS (0.67) FDPSBLMTDP1CA4BTN3A1
Pyrophosphoric Acid SCHEMBL2407700 0.88 FDPS (0.67) FDPSBLMTDP1CA4BTN3A1
Pyrophosphoric Acid SCHEMBL19458367 0.88 FDPS (0.67) FDPSBLMTDP1CA4BTN3A1
Pyrophosphoric Acid SCHEMBL229477 0.88 FDPS (0.67) FDPSBLMTDP1CA4BTN3A1
Triphosphate SCHEMBL28163378 0.85 TDP1 (0.53) FDPSBLMTDP1CA4BTN3A1
Triphosphate SCHEMBL2268534 0.84 FDPS (0.60) FDPSBLMTDP1CA4BTN3A1
Triphosphate SCHEMBL18714 0.84 FDPS (0.69) FDPSBLMTDP1CA4BTN3A1
Triphosphate SCHEMBL15555988 0.84 FDPS (0.69) FDPSBLMTDP1CA4BTN3A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000077139-A1 MACHINE DISHWASHING DETERGENTS CONTAINING SPECIAL PHOSPHATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-12-21 WO claimed
WO-2000077139-A1 MACHINE DISHWASHING DETERGENTS CONTAINING SPECIAL PHOSPHATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-12-21 WO disclosed
WO-2000077139-A1 MACHINE DISHWASHING DETERGENTS CONTAINING SPECIAL PHOSPHATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-12-21 WO disclosed