Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SLC6A5 | Q9Y345 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6986450 | 0.99 | ALDH1A1 (0.40) | ALDH1A1KMT2ATSHRSLC6A5KDM4E | |
| SCHEMBL6986879 | 0.88 | KMT2A (0.42) | ALDH1A1KMT2ATSHRKDM4EORAI1 | |
| Hydrochloric Acid SCHEMBL6494015 | 0.87 | KMT2A (0.41) | ALDH1A1KMT2ATSHRKDM4EORAI1 | |
| SCHEMBL6985018 | 0.84 | F10 (0.49) | ALDH1A1KDM4EL3MBTL3L3MBTL1STAT3 | |
| Hydrochloric Acid SCHEMBL6582680 | 0.78 | F10 (0.45) | ALDH1A1KMT2AKDM4EACHEMEN1 | |
| Hydrochloric Acid SCHEMBL6582721 | 0.78 | F10 (0.40) | ALDH1A1KMT2AKDM4EMEN1NPC1 | |
| SCHEMBL4832287 | 0.77 | SCD (0.50) | ALDH1A1TSHRKDM4EACHEL3MBTL3 | |
| SCHEMBL4844807 | 0.72 | KDM4E (0.52) | ALDH1A1KMT2AKDM4EACHEL3MBTL3 | |
| Hydrochloric Acid SCHEMBL6982358 | 0.72 | ROCK2 (0.41) | ALDH1A1KMT2AACHEMAPTHRH3 | |
| SCHEMBL4832356 | 0.71 | KRAS (0.51) | ALDH1A1KDM4EACHEL3MBTL3L3MBTL1 |
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-1289972-A1 | SERINE PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2003-03-12 | — | — | EP | claimed |
| WO-2001096323-A1 | SERINE PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2001-12-20 | — | — | WO | claimed |