Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7373311 | 0.93 | ALDH1A1 (0.40) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7371794 | 0.90 | KDM4E (0.40) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7385820 | 0.83 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7372480 | 0.81 | BACE1 (0.45) | — | |
| SCHEMBL7447534 | 0.81 | HRH3 (0.37) | ESR1ESR2 | |
| SCHEMBL7373580 | 0.80 | KDM4E (0.45) | KDM4EMEN1KMT2AESR1ESR2 | |
| SCHEMBL7368910 | 0.78 | LTA4H (0.39) | ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL7368854 | 0.78 | KCNH2 (0.35) | ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL7386276 | 0.77 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2AHTT | |
| SCHEMBL7371832 | 0.76 | SIGMAR1 (0.40) | ALDH1A1KDM4E |
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-0994859-A1 | COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-26 | — | — | EP | claimed |
| WO-1999001437-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | claimed |
| EP-0994859-A1 | COMPOUNDS | Astra Aktiebolag (publ) (SE) | 2000-04-26 | — | — | EP | disclosed |
| WO-1999001437-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (PUBL) (SE) | 1999-01-14 | — | — | WO | disclosed |