Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BIRC5 | O15392 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 7/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 7/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HK1 | P19367 | 1/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20033090 | 0.85 | HSD17B1 (0.49) | ESR1ESR2HSD17B1HSD17B2SLC9A1 | |
| SCHEMBL1527443 | 0.81 | BIRC5 (0.51) | BIRC5ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL30366175 | 0.80 | CYP2A6 (0.52) | MAOASLC9A1ALDH1A1CYP1A2MEN1 | |
| SCHEMBL29656897 | 0.80 | CYP2A6 (0.52) | MAOASLC9A1ALDH1A1CYP1A2MEN1 | |
| SCHEMBL1461517 | 0.80 | CYP2A6 (0.52) | MAOASLC9A1ALDH1A1CYP1A2MEN1 | |
| SCHEMBL1527474 | 0.77 | BIRC5 (0.47) | BIRC5ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL15197469 | 0.77 | CYP2A6 (0.56) | BIRC5ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL15624388 | 0.77 | ALDH1A1 (0.50) | BIRC5MAOBMAOAALDH1A1RAB9A | |
| SCHEMBL29398919 | 0.77 | ALDH1A1 (0.50) | BIRC5MAOBMAOAALDH1A1RAB9A | |
| SCHEMBL191276 | 0.77 | ALDH1A1 (0.50) | BIRC5MAOBMAOAALDH1A1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022068292-A1 | ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME | 陕西莱特光电材料股份有限公司 | 2022-04-07 | — | — | WO | disclosed |