Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21729626 | 0.85 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL17563242 | 0.77 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL17563460 | 0.77 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL17563241 | 0.77 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL11071047 | 0.74 | TSHR (0.43) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL2900931 | 0.74 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL37382 | 0.73 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2MAPK1L3MBTL1SLC6A2 | |
| SCHEMBL11108392 | 0.72 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL1286990 | 0.72 | KMT2A (0.40) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 | |
| SCHEMBL10783810 | 0.72 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2477993-A1 | SUBSTITUTED CLAVULANIC ACID | Nabriva Therapeutics AG (AT) | 2012-07-25 | — | — | EP | disclosed |
| WO-2011032192-A1 | SUBSTITUTED CLAVULANIC ACID | NABRIVA THERAPEUTICS AG (AT) | 2011-03-24 | — | — | WO | disclosed |