Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2351830 | 1.00 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL6122148 | 1.00 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL10898144 | 0.87 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL8859546 | 0.87 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL14498308 | 0.84 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL10899919 | 0.83 | HCAR2 (0.51) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL9142295 | 0.83 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL18652196 | 0.80 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL14498309 | 0.79 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A | |
| SCHEMBL10898992 | 0.79 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1MAPK1KMT2A |
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-2358663-A1 | ENANTIOSELECTIVE SYNTHESIS OF -AMINO- , -UNSATURATED CARBOXYLIC ACID DERIVATIVES | Novartis AG (CH) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010055162-A1 | ENANTIOSELECTIVE SYNTHESIS OF γ-AMINO-α,β-UNSATURATED CARBOXYLIC ACID DERIVATIVES | NOVARTIS AG (CH) | 2010-05-20 | — | — | WO | disclosed |