Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.57 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.57 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.57 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 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 | |
|---|---|---|---|---|
| SCHEMBL12061944 | 0.88 | LMNA (0.73) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL10180657 | 0.85 | LMNA (0.59) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL12480670 | 0.84 | L3MBTL1 (0.61) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL13170081 | 0.83 | L3MBTL1 (0.64) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL2094767 | 0.82 | NPC1 (0.63) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL2095973 | 0.81 | ALDH1A1 (0.60) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL2095975 | 0.81 | ALDH1A1 (0.60) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL29991055 | 0.81 | NPC1 (0.55) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL27833511 | 0.81 | NPC1 (0.55) | LMNAPOLBPDK1PDK2PDK3 | |
| SCHEMBL167677 | 0.80 | ALDH1A1 (0.63) | LMNAPOLBPDK1PDK2PDK3 |
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-1567477-A1 | SUBSTITUTED AMINO PHENYLACETIC ACIDS, DERIVATIVES THEREOF, THEIR PREPARATION AND THEIR USE AS CYCLOOXYGENASE 2 (COX-2) INHIBITORS | Novartis AG (CH) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004048314-A1 | SUBSTITUTED AMINO PHENYLACETIC ACIDS, DERIVATIVES THEREOF, THEIR PREPARATION AND THEIR USE AS CYCLOOXYGENASE 2 (COX-2) INHIBITORS | NOVARTIS AG (CH) | 2004-06-10 | — | — | WO | disclosed |