Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | POLB | P06746 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | XPA | P23025 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9138199 | 0.76 | ALDH1A1 (0.35) | ALDH1A1POLBLMNAMAPTRXFP1 | |
| SCHEMBL11859778 | 0.75 | POLB (0.42) | ALDH1A1POLBLMNAMAPTHPGD | |
| SCHEMBL9581685 | 0.74 | BCAT1 (0.46) | ALDH1A1POLBLMNATDP1CTSB | |
| SCHEMBL11392730 | 0.73 | SMN1; SMN2 (0.48) | POLBLMNAMAPTHPGDL3MBTL1 | |
| SCHEMBL9706647 | 0.72 | SLC6A2 (0.37) | ALDH1A1POLBLMNAMAPTTDP1 | |
| SCHEMBL11840285 | 0.72 | KDM4E (0.47) | ALDH1A1LMNAMAPTRXFP1CYP2C19 | |
| SCHEMBL11824631 | 0.72 | SMN1; SMN2 (0.47) | POLBLMNAMAPTHPGDL3MBTL1 | |
| SCHEMBL10645440 | 0.71 | TDP1 (0.40) | ALDH1A1POLBLMNAMAPTRXFP1 | |
| SCHEMBL11248751 | 0.69 | ALDH1A1 (0.43) | ALDH1A1POLBLMNAMAPTCYP2C19 | |
| SCHEMBL11394388 | 0.68 | HCAR1 (0.45) | ALDH1A1POLBLMNAMAPTTDP1 |
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-5447904-A | Herbicides and chemical intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1995-09-05 | — | — | US | disclosed |
| EP-0584655-A2 | 3-Aryl-triazine-2,4-diones as herbicides | BAYER AG (DE) | 1994-03-02 | — | — | EP | disclosed |