Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 8/20 | 0.47 |
| ▸ | RAB9A | P51151 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HPGDS | O60760 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22558832 | 0.80 | CES2 (0.47) | CES2CES1DAONPC1RAB9A | |
| SCHEMBL22558317 | 0.80 | CES2 (0.47) | CES2CES1DAONPC1RAB9A | |
| SCHEMBL6378691 | 0.78 | — | — | |
| SCHEMBL3891475 | 0.77 | HDAC1 (0.47) | CES2CES1DAONPC1RAB9A | |
| SCHEMBL5673867 | 0.76 | NPC1 (0.43) | CES2CES1DAONPC1RAB9A | |
| SCHEMBL13843775 | 0.75 | — | — | |
| SCHEMBL6199324 | 0.74 | — | — | |
| SCHEMBL10178708 | 0.73 | NPC1 (0.67) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL29090135 | 0.72 | CES2 (0.56) | CES2CES1DAONPC1RAB9A | |
| SCHEMBL9709882 | 0.72 | DAO (0.59) | CES2CES1DAONPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0044142-A1 | Process for the preparation of beta-lactam antibiotics | BEECHAM GROUP PLC (GB) | 1982-01-20 | — | — | EP | disclosed |