Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27588539 | 0.79 | MEN1 (0.43) | KMT2AALDH1A1GAA | |
| SCHEMBL27281829 | 0.79 | HSP90AA1 (0.41) | MGLLKMT2AADORA3ADORA2AALDH1A1 | |
| SCHEMBL27967289 | 0.79 | ALDH1A1 (0.43) | FAAHMGLLKMT2ANOTUMALDH1A1 | |
| SCHEMBL27606547 | 0.79 | MAPT (0.48) | KMT2AALDH1A1MAPTCYP11B1CYP11B2 | |
| SCHEMBL2446722 | 0.79 | NOTUM (0.49) | MGLLNOTUMIDO1ALDH1A1POLB | |
| SCHEMBL63013 | 0.78 | CYP3A4 (0.40) | MGLLKMT2ANOTUMPOLBGAA | |
| SCHEMBL6610287 | 0.77 | NOTUM (0.42) | MGLLKMT2ANOTUMALDH1A1MAPT | |
| SCHEMBL11324213 | 0.76 | NOTUM (0.51) | MGLLPI4KAPI4K2BPI4K2API4KB | |
| SCHEMBL27606291 | 0.75 | LMNA (0.45) | ALDH1A1 | |
| SCHEMBL27665998 | 0.75 | RXRA (0.39) | NOTUMALDH1A1MAPTRXRAGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5066652-A | ANTIULCER AGENTS | CHIESI FARMACEUTICI S.P.A. (IT) | 1991-11-19 | — | — | US | claimed |
| EP-0301422-A2 | Thiomethyl and sulfinylmethyl derivatives having gastric acid antisecretory activity, processes for the preparation thereof and pharmaceutical compositions containing them | CHIESI FARMACEUTICI S.p.A. (IT) | 1989-02-01 | — | — | EP | claimed |