Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 6/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.49 |
| ▸ | GPX4 | P36969 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24011585 | 0.86 | HSD17B1 (0.53) | ALDH1A1HSD17B1HSD17B2TP53RAB9A | |
| SCHEMBL31425823 | 0.86 | HSD17B1 (0.53) | ALDH1A1HSD17B1HSD17B2TP53RAB9A | |
| SCHEMBL11338671 | 0.83 | HSD17B1 (0.53) | ALDH1A1HSD17B1HSD17B2TP53RAB9A | |
| SCHEMBL28746541 | 0.82 | EGFR (0.48) | ALDH1A1KMT2AMEN1TP53LMNA | |
| SCHEMBL28746511 | 0.82 | TP53 (0.46) | ALDH1A1KMT2AMEN1TP53LMNA | |
| SCHEMBL28746573 | 0.82 | LTB4R2 (0.47) | ALDH1A1TP53RAB9ANPC1LMNA | |
| SCHEMBL15979067 | 0.82 | HTR3E (0.53) | ALDH1A1HSD17B1HSD17B2KMT2ATP53 | |
| SCHEMBL9674499 | 0.81 | HSD17B1 (0.51) | ALDH1A1HSD17B1HSD17B2TP53RAB9A | |
| SCHEMBL11661832 | 0.81 | ALDH1A1 (0.60) | ALDH1A1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL95584 | 0.81 | HSD17B1 (0.51) | ALDH1A1HSD17B1HSD17B2TP53RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114539121-A | A novel, photo-promoted process for the preparation of sulfonates and sulfonamides from sulfonyl chlorides | 天津师范大学 | 2022-05-27 | — | — | CN | disclosed |
| EP-3394056-B1 | COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE | SHY Therapeutics LLC (US) | 2021-04-14 | — | — | EP | disclosed |