Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL9568209 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL6650547 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL6711344 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL2562532 | 0.79 | ALDH1A1 (0.63) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL347596 | 0.77 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL7651972 | 0.77 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL7718190 | 0.77 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL10826970 | 0.76 | ALDH1A1 (0.45) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL9677845 | 0.76 | ALDH1A1 (0.59) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 | |
| SCHEMBL29901844 | 0.76 | ALDH1A1 (0.59) | ALDH1A1MAPK1L3MBTL1HCAR2TDP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1169328-A2 | AVERMECTIN DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000058328-A2 | AVERMECTIN DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-10-05 | — | — | WO | disclosed |
| US-4609495-A | BETA-LACTAMASE INHIBITORS, ANTIBIOTICS | BEECHAM GROUP P.L.C. (GB) | 1986-09-02 | — | — | US | disclosed |
| US-4548815-A | SYNERGISTIC MIXTURE OF AN OXAPENICILLIN AND A PENICILLIN | BEECHAM GROUP P.L.C. (GB) | 1985-10-22 | — | — | US | disclosed |
| US-4228174-A | ANTIBIOTICS | BEECHAM GROUP LIMITED (GB) | 1980-10-14 | — | — | US | disclosed |