Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 2/20 | 0.52 |
| ▸ | BACE1 | P56817 | 2/20 | 0.52 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8184326 | 0.85 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL20809471 | 0.84 | RAB9A (0.49) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL12577886 | 0.82 | IDO1 (0.52) | ALDH1A1POLBGSK3BBACE1KDM4E | |
| SCHEMBL13220843 | 0.82 | RAB9A (0.53) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL18002461 | 0.81 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL19595052 | 0.81 | MAOB (0.56) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL2168244 | 0.81 | TSHR (0.60) | ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL7024313 | 0.80 | CACNA1C (0.53) | ALDH1A1KMT2AMEN1GSK3BBACE1 | |
| SCHEMBL29476018 | 0.80 | RAB9A (0.44) | ALDH1A1KMT2AMEN1POLBHPGD | |
| SCHEMBL14762631 | 0.79 | CACNA1C (0.50) | GSK3BBACE1CACNA1CMAOBALKBH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |
| WO-2016019588-A1 | OXACAZONE COMPOUNDS TO TREAT CLOSTRIDIUM DIFFICILE | THE BROAD INSTITUTE, INC. (US) | 2016-02-11 | — | — | WO | disclosed |