Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31519796 | 0.93 | CYP1A2 (0.58) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL29264883 | 0.93 | CYP1A2 (0.58) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL825527 | 0.93 | CYP1A2 (0.58) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL29501087 | 0.93 | CYP1A2 (0.56) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| Hydrochloric Acid SCHEMBL28881057 | 0.91 | CYP1A2 (0.56) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL6763194 | 0.91 | CYP1A2 (0.56) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL6761040 | 0.91 | CYP1A2 (0.54) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL6761903 | 0.88 | CYP1A2 (0.44) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL4981072 | 0.81 | CYP2A6 (0.37) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL4983268 | 0.79 | ALDH1A1 (0.72) | CYP2A6CYP1A2ALDH1A1HSD17B10HPGD |
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-3183250-B1 | PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL | CLAP CO LTD (KR) | 2023-10-04 | — | — | EP | disclosed |
| EP-3183757-B1 | ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM | CLAP CO LTD (KR) | 2022-05-04 | — | — | EP | disclosed |