Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29495045 | 0.82 | ALDH1A1 (1.00) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| SCHEMBL55544 | 0.82 | ALDH1A1 (1.00) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| Hydrochloric Acid SCHEMBL10706930 | 0.80 | ALDH1A1 (0.95) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| SCHEMBL10208072 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CYP3A4ADRA2BPTGS1TDP1 | |
| 2,5-Xylidine SCHEMBL9308900 | 0.75 | ALDH1A1 (0.84) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| SCHEMBL11993859 | 0.75 | ALDH1A1 (0.69) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| Orthocresol SCHEMBL11881671 | 0.74 | ALDH1A1 (0.68) | ALDH1A1CYP3A4SLC6A4ACHEADRA2B | |
| Sulfuric Acid SCHEMBL10957580 | 0.73 | ALDH1A1 (0.78) | ALDH1A1CYP3A4ACHETDP1MEN1 | |
| SCHEMBL7883774 | 0.71 | ACHE (0.48) | ALDH1A1CYP3A4ACHETDP1MEN1 | |
| SCHEMBL11354738 | 0.71 | ALDH1A1 (0.75) | ALDH1A1CYP3A4SLC6A4ACHETDP1 |
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-0373110-B1 | PRESSURE-SENSITIVE OR HEAT-SENSITIVE RECORDING MATERIAL | CIBA-GEIGY AG (CH) | 1993-04-21 | — | — | EP | disclosed |
| EP-0373110-A2 | Pressure-sensitive or heat-sensitive recording material | CIBA-GEIGY AG (CH) | 1990-06-13 | — | — | EP | disclosed |