Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5700142 | 0.78 | — | — | |
| SCHEMBL13841188 | 0.73 | CA12 (0.53) | GAASLC6A4SLC6A2CA12CA2 | |
| SCHEMBL29911950 | 0.73 | CA12 (0.53) | GAASLC6A4SLC6A2CA12CA2 | |
| SCHEMBL18430045 | 0.73 | CSNK2A1 (0.46) | GAASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL3026363 | 0.72 | GAA (0.45) | GAASLC6A4SLC6A2SLC6A3CA12 | |
| SCHEMBL28480029 | 0.72 | CHRNB2 (0.40) | CA12CA2CA9CA1CYP1A2 | |
| SCHEMBL8464066 | 0.71 | LMNA (0.42) | SLC6A4SLC6A2SLC6A3CA12CA2 | |
| SCHEMBL31036947 | 0.71 | LMNA (0.42) | SLC6A4SLC6A2SLC6A3CA12CA2 | |
| SCHEMBL11640386 | 0.71 | ALDH1A1 (0.40) | CA12CA2CA9CA1CYP1A2 | |
| SCHEMBL27805730 | 0.71 | KDM4E (0.46) | GAACA12CA2CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4119775-A | ANTIBACTERIAL | RICHARDSON-MERRELL INC. (US) | 1978-10-10 | — | — | US | disclosed |
| US-3989687-A | ANTIBACTERIAL | RICHARDSON-MERRELL INC. (US) | 1976-11-02 | — | — | US | disclosed |