Phosphoric Acid

Phosphoric Acid

SCHEMBL28725937

N#CC=CC1CCC(n2cc(-c3ncnc4[nH]ccc34)cn2)C1.O=P(O)(O)O

nearest known ligand 0.55

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Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 known ✓ O60674 19/20 0.55
JAK1 known ✓ P23458 18/20 0.55
JAK3 known ✓ P52333 6/20 0.55
TYK2 known ✓ P29597 2/20 0.55
KIT known ✓ P10721 1/20 0.47
FGFR1 known ✓ P11362 1/20 0.47
DAPK3 O43293 2/20 0.47
PAK4 O96013 2/20 0.47
ABL1 P00519 2/20 0.47
RET P07949 2/20 0.47
LTK P29376 2/20 0.47
CSNK1A1 P48729 2/20 0.47
CLK2 P49760 2/20 0.47
TNK2 Q07912 2/20 0.47
ROCK1 Q13464 2/20 0.47
DYRK1A Q13627 2/20 0.47
IKBKE Q14164 2/20 0.47
NTRK3 Q16288 2/20 0.47
NTRK2 Q16620 2/20 0.47
LRRK2 Q5S007 2/20 0.47

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
Phosphoric Acid SCHEMBL27231611 0.81 JAK2 (0.57) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL98880 0.76 JAK2 (0.51) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL101693 0.75 JAK2 (0.57) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL101692 0.75 JAK2 (0.57) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL30663312 0.75 JAK2 (0.57) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL29080511 0.75 JAK2 (0.53) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL3377812 0.74 JAK2 (0.57) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL18522662 0.74 JAK2 (0.54) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL101170 0.74 JAK2 (0.56) JAK2JAK1JAK3TYK2DAPK3
SCHEMBL20943726 0.73 JAK2 (0.49) JAK2JAK1JAK3TYK2DAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114044777-B Preparation method of tricitabinib phosphate 南京佰麦生物技术有限公司 2022-04-19 CN disclosed
CN-114044777-A Preparation method of tricitabinib phosphate 南京佰麦生物技术有限公司 2022-02-15 CN disclosed