Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITPR3 | Q14573 | 8/20 | 0.89 |
| ▸ | ITPR2 | Q14571 | 4/20 | 0.89 |
| ▸ | ITPR1 | Q14643 | 4/20 | 0.89 |
| ▸ | INPP5A | Q14642 | 3/20 | 0.89 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.89 |
| ▸ | AKT1 | P31749 | 1/20 | 0.89 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.88 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1331808 | 1.00 | ITPR3 (0.89) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| SCHEMBL9439385 | 1.00 | ITPR3 (0.89) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| SCHEMBL29635055 | 1.00 | ITPR3 (0.89) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| SCHEMBL8441712 | 1.00 | ITPR3 (0.89) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL29635044 | 0.97 | ITPR3 (0.94) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL406796 | 0.97 | ITPR3 (0.94) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL29635038 | 0.97 | ITPR3 (0.94) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL13951027 | 0.97 | ITPR3 (0.94) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL15209904 | 0.97 | ITPR3 (0.94) | ITPR3ITPR2ITPR1INPP5AINPPL1 | |
| Ionositol (1,3,4,5,6) P5 SCHEMBL29635093 | 0.97 | ITPR3 (0.94) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5292913-A | Labeling with deuterium or tritium | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1994-03-08 | — | — | US | disclosed |
| US-4952717-A | Myoinositol derivatives and preparation process thereof | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1990-08-28 | — | — | US | disclosed |
| EP-0262227-A1 | Process for the preparation of myoinositol derivatives | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1988-04-06 | — | — | EP | disclosed |