Sugi Predict

Sugi Predict / Compounds / Pyridine

Pyridine

Pyridine

SCHEMBL28845864

COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.[NaH].c1ccncc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NAPRT Q6XQN6 1/20 0.32
▸ FDPS P14324 1/20 0.31
▸ BLM P54132 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 SCHEMBL28958469 0.89 TDP1 (0.41) BTN3A1TDP1TSHRNAPRTFDPS
Triphosphate SCHEMBL27789890 0.87 TDP1 (0.43) BTN3A1TDP1TSHRNAPRTFDPS
Pyridine SCHEMBL28174103 0.82 TSHR (0.43) TDP1TSHRNAPRT
Phosphoric Acid Monomethyl Ester SCHEMBL21054852 0.80 TDP1 (0.45) TDP1TSHRNAPRTFDPSBLM
Phosphoric Acid Monomethyl Ester SCHEMBL21054851 0.80 TDP1 (0.45) TDP1TSHRNAPRTFDPSBLM
SCHEMBL687243 0.80 FDPS (0.47) BTN3A1TDP1FDPSBLM
SCHEMBL16855741 0.80 FDPS (0.47) BTN3A1TDP1FDPSBLM
SCHEMBL412533 0.80 FDPS (0.47) BTN3A1TDP1FDPSBLM
SCHEMBL10862597 0.78 FDPS (0.45) BTN3A1TDP1FDPSBLM
Pyrophosphoric Acid SCHEMBL1333626 0.78 FDPS (0.53) TDP1TSHRNAPRTFDPSBLM

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
CN-110327317-B Application of alkannin in preparing medicine for resisting rotavirus infection 东莞市松山湖中心医院(东莞市石龙人民医院、东莞市第三人民医院、东莞市心血管病研究所) 2022-09-20 — — CN disclosed