Atrinositol

Atrinositol

SCHEMBL9489238

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

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 1.00
ITPR2 Q14571 4/20 0.94
ITPR1 Q14643 4/20 0.94
INPP5A Q14642 2/20 0.80
INPPL1 O15357 1/20 0.80
AKT1 P31749 1/20 0.80
SMPD1 P17405 1/20 0.70

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
Atrinositol SCHEMBL134177 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL9022890 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL636077 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL355653 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL888326 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL30474862 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL29370539 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL180074 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL26683544 0.97 ITPR3 (0.95) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL405897 0.97 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0359260-B1 THE USE OF INOSITOLTRISPHOSPHATE FOR THE PREPARING OF A MEDICAMENT AGAINST ABNORMAL LEVELS OF LIPOPROTEINS PERSTORP AB (SE) 1993-04-21 EP disclosed
EP-0359256-B1 THE USE OF INOSITOLTRISPHOSPHATE IN THE TREATMENT OF TISSUE DAMAGE PERSTORP AB (SE) 1993-01-20 EP disclosed
US-5057507-A Method of alleviating bone damage with inositoltriphosphate PERSTORP AB (SE) 1991-10-15 US disclosed
US-5015634-A Wound healing agents PERSTORP AB (SE) 1991-05-14 US disclosed
EP-0359258-A2 The use of inositoltrisphosphate for the preparing of a medicament against bone disorders PERSTORP AB (SE) 1990-03-21 EP disclosed
EP-0359260-A2 The use of inositoltrisphosphate for the preparing of a medicament against abnormal levels of lipoproteins PERSTORP AB (SE) 1990-03-21 EP disclosed
EP-0359256-A2 The use of inositoltrisphosphate in the treatment of tissue damage PERSTORP AB (SE) 1990-03-21 EP disclosed