Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7385820 | 0.94 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7377488 | 0.89 | ALDH1A1 (0.36) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7531708 | 0.89 | CHEK1 (0.39) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7377148 | 0.89 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7387732 | 0.89 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7425609 | 0.88 | ALDH1A1 (0.41) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7383707 | 0.88 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7373311 | 0.83 | ALDH1A1 (0.40) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7389488 | 0.80 | HRH3 (0.45) | KCNH2HRH3 | |
| SCHEMBL7377888 | 0.79 | KCNH2 (0.36) | ALDH1A1KMT2AKCNH2HRH3LTA4H |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0993450-A1 | NEW COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-19 | — | — | EP | claimed |
| WO-1999001438-A1 | NEW COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | claimed |
| EP-0993450-A1 | NEW COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-19 | — | — | EP | disclosed |
| WO-1999001438-A1 | NEW COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | disclosed |