Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4004912 | 0.85 | MAPT (0.48) | ALDH1A1TDP1EGFRMAPTLMNA | |
| SCHEMBL30711414 | 0.71 | UHRF1 (0.39) | EGFRKMT2AHTT | |
| SCHEMBL1584807 | 0.71 | UHRF1 (0.39) | EGFRKMT2AHTT | |
| SCHEMBL19964834 | 0.70 | SIRT2 (0.56) | NPC1RAB9AATRMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL20266526 | 0.69 | UHRF1 (0.38) | EGFR | |
| SCHEMBL19243778 | 0.69 | GAA (0.49) | ALDH1A1TDP1EGFRMAPTSMN1; SMN2 | |
| SCHEMBL29831973 | 0.68 | MAPT (0.64) | ALDH1A1CTSDTDP1MAPTLMNA | |
| SCHEMBL9222331 | 0.68 | MAPT (0.64) | ALDH1A1CTSDTDP1MAPTLMNA | |
| SCHEMBL15286061 | 0.66 | KDM4E (0.47) | ALDH1A1EGFRMAPTLMNASMN1; SMN2 | |
| SCHEMBL16217238 | 0.66 | ALDH1A1 (0.52) | ALDH1A1CTSDTDP1EGFRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018048930-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | PHARMAKEA, INC. (US) | 2018-03-15 | — | — | WO | disclosed |