Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | GALR1 | P47211 | 1/20 | 0.59 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.59 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL4193217 | 0.98 | TP53 (0.61) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL2404818 | 0.95 | NPC1 (0.59) | TP53POLBHPGDNPC1ALDH1A1 | |
| SCHEMBL5863201 | 0.93 | TP53 (0.57) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL11223090 | 0.93 | TP53 (0.59) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL5863231 | 0.92 | TP53 (0.56) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL3900684 | 0.92 | NPC1 (0.56) | TP53POLBHPGDGALR1CA12 | |
| SCHEMBL6225292 | 0.90 | KDM4E (0.57) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL3731320 | 0.90 | SMN1; SMN2 (0.60) | TP53POLBHPGDGALR1CYP4F2 | |
| SCHEMBL2771575 | 0.90 | CA12 (0.62) | TP53POLBHPGDCA12CA1 | |
| SCHEMBL110276 | 0.90 | CYP4F2 (0.65) | CYP4F2CYP4A11CA12CA1CA2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114478563-A | Method for quickly crystallizing isosorbide | 国科温州研究院(温州生物材料与工程研究所) | 2022-05-13 | — | — | CN | claimed |
| CN-114478563-A | Method for quickly crystallizing isosorbide | 国科温州研究院(温州生物材料与工程研究所) | 2022-05-13 | — | — | CN | disclosed |