Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ALDH5A1 | P51649 | 3/20 | 0.43 |
| ▸ | ABAT | P80404 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL9829442 | 0.79 | TDP1 (0.48) | KDM4EPTGS2RAB9AALDH1A1HPGD | |
| SCHEMBL11696316 | 0.79 | ALDH1A1 (0.42) | KDM4EPTGS2RAB9AALDH1A1TRIM24 | |
| SCHEMBL4650676 | 0.79 | ALDH1A1 (0.48) | KDM4EPTGS2RAB9AALDH1A1TDP1 | |
| SCHEMBL28143587 | 0.77 | KDM4E (0.42) | KDM4EPTGS2RAB9AALDH5A1ABAT | |
| SCHEMBL15652730 | 0.77 | KDM4E (0.42) | KDM4EPTGS2RAB9AALDH5A1ABAT | |
| SCHEMBL6177668 | 0.75 | TYR (0.44) | KDM4EPTGS2RAB9AALDH1A1HPGD | |
| SCHEMBL11234082 | 0.75 | ALDH1A1 (0.48) | KDM4ERAB9AALDH5A1ABATALDH1A1 | |
| SCHEMBL26261539 | 0.75 | NPC1 (0.53) | KDM4ERAB9AALDH1A1MEN1NPC1 | |
| SCHEMBL15653241 | 0.73 | KDM4E (0.47) | KDM4EPTGS2RAB9AALDH5A1ABAT | |
| SCHEMBL29951143 | 0.73 | KDM4E (0.47) | KDM4EPTGS2RAB9AALDH5A1ABAT |
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-4184977-A | WHITENING | BAYER AKTIENGESELLSCHAFT (DE) | 1980-01-22 | — | — | US | disclosed |
| EP-0000346-A1 | Quinoxaline compounds, process for their manufacture and their use as brighteners for organic materials, and the materials brightened therewith | BAYER AG (DE) | 1979-01-24 | — | — | EP | disclosed |