Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1506643 | 0.84 | ALDH1A1 (0.62) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL21578106 | 0.82 | ALDH1A1 (0.65) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL13718321 | 0.75 | ALDH1A1 (0.54) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL23441147 | 0.74 | ALDH1A1 (0.48) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL3126897 | 0.73 | LMNA (0.46) | ALDH1A1GAASRD5A2HPGDLMNA | |
| SCHEMBL11525100 | 0.73 | CYP2C9 (0.51) | ALDH1A1ATMHPGDLMNATP53 | |
| SCHEMBL29287570 | 0.70 | ALDH1A1 (0.48) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL28425427 | 0.70 | ALDH1A1 (0.48) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL13718952 | 0.69 | ALDH1A1 (0.46) | ALDH1A1GAAATMTDP1L3MBTL1 | |
| SCHEMBL7639283 | 0.68 | BCL2L1 (0.48) | ALDH1A1ATMSRD5A2NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0085554-A1 | Molecular analytical release tags and their use in chemical analysis | NORTHEASTERN UNIVERSITY (US) | 1983-08-10 | — | — | EP | disclosed |