Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CPB1 | P15086 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7359299 | 0.93 | HTT (0.44) | HTTCCR6PAX8ALDH1A1MAPK1 | |
| SCHEMBL7352897 | 0.91 | HTT (0.43) | HTTCCR6PAX8ALDH1A1MAPK1 | |
| SCHEMBL8029844 | 0.90 | HTT (0.42) | HTTCCR6PAX8ALDH1A1MAPK1 | |
| SCHEMBL7242187 | 0.90 | HTT (0.42) | HTTCCR6PAX8ALDH1A1MAPK1 | |
| SCHEMBL989683 | 0.88 | CCR6 (0.45) | CCR6PAX8ALDH1A1PLAUCA12 | |
| SCHEMBL7358565 | 0.87 | CCR6 (0.39) | CCR6PAX8ALDH1A1PLAUCA12 | |
| SCHEMBL9228435 | 0.87 | ALDH1A1 (0.41) | CCR6PAX8ALDH1A1PLAUCA12 | |
| SCHEMBL8039587 | 0.86 | CCR6 (0.42) | HTTCCR6PAX8ALDH1A1MAPK1 | |
| SCHEMBL6560598 | 0.83 | HTT (0.54) | HTTCCR6PAX8ALDH1A1CA12 | |
| SCHEMBL6661417 | 0.83 | CCR6 (0.41) | CCR6PAX8ALDH1A1PLAUMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999048911-A1 | MONOBACTAM ENZYME INHIBITORS | NAEJA PHARMACEUTICAL INC. (GB) | 1999-09-30 | — | — | WO | disclosed |
| EP-0646573-A1 | Preparation of protected and unprotected guanidino-substituted carboxylic acids | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-04-05 | — | — | EP | disclosed |