Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA7 | P43166 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9368020 | 0.89 | CA1 (0.56) | SMN1; SMN2CA12CA1CA2CA7 | |
| SCHEMBL571300 | 0.85 | CA1 (0.59) | SMN1; SMN2CA12CA1CA2CA7 | |
| SCHEMBL13577833 | 0.83 | LOXL2 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL22751983 | 0.83 | LOXL2 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2232200 | 0.83 | CA1 (0.58) | SMN1; SMN2CA12CA1CA2CA7 | |
| SCHEMBL23582892 | 0.83 | LOXL2 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2232390 | 0.82 | LMNA (0.59) | SMN1; SMN2CA12CA1CA2CA7 | |
| SCHEMBL11647879 | 0.81 | TBXAS1 (0.53) | ESR1LMNAMEN1KMT2AHPGD | |
| SCHEMBL11996333 | 0.81 | TBXAS1 (0.53) | ESR1LMNAMEN1KMT2AHPGD | |
| SCHEMBL3956396 | 0.81 | CA1 (0.54) | SMN1; SMN2CA12CA1CA2CA7 |
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-1368295-A1 | PROCESS FOR THE MANUFACTURE OF PHENYLACETIC ACID DERIVATIVES | F. Hoffman-la Roche AG (CH) | 2003-12-10 | — | — | EP | disclosed |
| WO-2002079134-A1 | PROCESS FOR THE MANUFACTURE OF PHENYLACETIC ACID DERIVATIVES | F. HOFFMANN-LA-ROCHE AG (CH) | 2002-10-10 | — | — | WO | disclosed |