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Phytic Acid

Phytic Acid

SCHEMBL9325946

O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ITPR3 Q14573 8/20 0.77
▸ ITPR2 Q14571 4/20 0.72
▸ ITPR1 Q14643 4/20 0.72
▸ INPPL1 O15357 1/20 0.72
▸ AKT1 P31749 1/20 0.72
▸ SMPD1 P17405 1/20 0.71
▸ INPP5A Q14642 3/20 0.63

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
Phytic Acid SCHEMBL9164308 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL141097 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL1682030 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL17006482 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL8467566 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL1681701 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL9741350 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL15374707 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytate SCHEMBL136587 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL12138455 1.00 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1

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
US-5306810-A Reducing and releasing the phytate from protein fiber by adjusting the acidity and alkalinity of solutions ABBOTT LABORATORIES (US) 1994-04-26 — — US disclosed
US-5248765-A Infant formula ABBOTT LABORATORIES (US) 1993-09-28 — — US disclosed
US-4016341-A REDUCING SCALE DEPOSITS BY COATING SURFACES WITH PHOSPHORIC ESTERS OR SALTS SHIN-ETSU CHEMICAL COMPANY LIMITED (JA) 1977-04-05 — — US disclosed