Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 9/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29218593 | 0.87 | KCNQ3 (0.47) | ALDH1A1EPHX2NPC1RAB9A | |
| SCHEMBL29218828 | 0.86 | EPHX2 (0.45) | EPHX2NPC1RAB9AEPHX1HDAC8 | |
| SCHEMBL29218851 | 0.86 | POLB (0.46) | ALDH1A1EPHX2FAAHNPC1RAB9A | |
| SCHEMBL28487447 | 0.86 | EPHX2 (0.45) | EPHX2NPC1RAB9AEPHX1HDAC8 | |
| SCHEMBL29218677 | 0.85 | HDAC3 (0.39) | ALDH1A1HDAC8HDAC6LMNAMAPT | |
| SCHEMBL29218746 | 0.83 | MAPT (0.37) | ALDH1A1EPHX2FAAHNPC1RAB9A | |
| SCHEMBL23573253 | 0.82 | RAB9A (0.65) | ALDH1A1EPHX2FAAHNPC1RAB9A | |
| SCHEMBL29218694 | 0.82 | HDAC8 (0.41) | ALDH1A1NPC1RAB9AHDAC8HDAC6 | |
| SCHEMBL29218717 | 0.82 | EPHX1 (0.44) | ALDH1A1EPHX2NPC1RAB9AEPHX1 | |
| SCHEMBL29218821 | 0.81 | LTA4H (0.50) | NPC1RAB9AEPHX1MAPT |
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-118076581-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-24 | — | — | CN | disclosed |
| CN-116964050-A | Compounds useful as T cell activators | 戈萨默生物服务公司 | 2023-10-27 | — | — | CN | disclosed |