Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAPDH | P04406 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28468188 | 0.87 | MMP2 (0.50) | HPGDTYRDAOAKR1B1MMP2 | |
| SCHEMBL28468189 | 0.87 | MMP2 (0.50) | HPGDTYRDAOAKR1B1MMP2 | |
| SCHEMBL7143401 | 0.78 | MMP2 (0.52) | GAPDHHPGDTYRDAOAKR1B1 | |
| SCHEMBL7142290 | 0.76 | POLB (0.51) | HPGDTYRDAOAKR1B1LMNA | |
| SCHEMBL9233570 | 0.76 | MAOA (0.51) | HPGDTYRDAOAKR1B1LMNA | |
| SCHEMBL7140695 | 0.75 | MAOB (0.50) | HPGDTYRDAOAKR1B1LMNA | |
| SCHEMBL8366995 | 0.73 | MAOB (0.57) | HPGDTYRDAOAKR1B1LMNA | |
| SCHEMBL31233351 | 0.72 | LCK (0.50) | MMP2MMP9MAOANPC1KMT2A | |
| SCHEMBL3267547 | 0.72 | MAOA (0.54) | HPGDTYRDAOAKR1B1LMNA | |
| SCHEMBL4185979 | 0.72 | MAOA (0.56) | GAPDHHPGDTYRDAOAKR1B1 |
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-2024028533-A1 | 2-(PYRROLIDIN-1-YL)THIAZOLE COMPOUNDS AND THEIR USE AS ANTIBIOTIC AGENTS | UNIVERSIDAD DE ALICANTE (ES) | 2024-02-08 | — | — | WO | disclosed |