Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2185727 | 0.94 | ALDH1A1 (0.46) | ALDH1A1IDO1TDO2SLC18A3SIGMAR1 | |
| SCHEMBL13963168 | 0.83 | CYP3A4 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL852720 | 0.83 | MEN1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL29626738 | 0.83 | MEN1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL343476 | 0.83 | MEN1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL1285074 | 0.83 | MEN1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL241692 | 0.82 | IDO1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL31476387 | 0.82 | IDO1 (0.47) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL16954053 | 0.82 | ALDH1A1 (0.41) | ALDH1A1IDO1TDO2MAPK1CYP3A4 | |
| SCHEMBL1812811 | 0.81 | SLC6A2 (0.51) | ALDH1A1IDO1TDO2MAPK1CYP3A4 |
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-1768989-A1 | METAL COMPLEXES | Covion Organic Semiconductors GmbH (DE) | 2007-04-04 | — | — | EP | disclosed |
| WO-2006008069-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2006-01-26 | — | — | WO | disclosed |