Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7332996 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL22692566 | 0.95 | ALDH1A1 (0.58) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL18510020 | 0.89 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL21445354 | 0.88 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL18430149 | 0.88 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL6963655 | 0.86 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL6889409 | 0.86 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| SCHEMBL29577012 | 0.85 | ALDH1A1 (0.51) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| Hydrochloric Acid SCHEMBL30878143 | 0.85 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDHSD17B10KMT2A | |
| Hydrochloric Acid SCHEMBL6889405 | 0.85 | ALDH1A1 (0.55) | ALDH1A1MAPTHPGDHSD17B10KMT2A |
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-0950046-B1 | 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS | NAEJA PHARMACEUTICAL INC (CA) | 2002-04-10 | — | — | EP | claimed |
| EP-0012401-A1 | Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them | MERCK & CO. INC. (US) | 1980-06-25 | — | — | EP | disclosed |