Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ACACB | O00763 | 5/20 | 0.42 |
| ▸ | ACACA | Q13085 | 5/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | PNLIP | P16233 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL128347 | 0.91 | ALDH1A3 (0.46) | ALDH1A3KMT2APARP10POLBGLA | |
| SCHEMBL27899588 | 0.89 | ALDH1A3 (0.45) | ALDH1A3KMT2APARP10POLBGLA | |
| SCHEMBL6282894 | 0.86 | ALDH1A3 (0.56) | ALDH1A3KMT2AACACBACACAPARP10 | |
| SCHEMBL533273 | 0.83 | ALDH1A3 (0.45) | ALDH1A3KMT2AACACBACACAPARP10 | |
| SCHEMBL2088447 | 0.80 | ACACB (0.37) | ACACBACACAMMP2MMP3MMP9 | |
| SCHEMBL14817450 | 0.79 | ACACB (0.59) | ALDH1A3KMT2AACACBACACAPARP10 | |
| SCHEMBL2094115 | 0.79 | PNLIP (0.39) | ALDH1A3KMT2AACACBACACAPARP10 | |
| SCHEMBL2262642 | 0.78 | ALDH1A1 (0.37) | KMT2APOLBALDH1A1 | |
| SCHEMBL125543 | 0.78 | ALDH1A3 (0.64) | ALDH1A3KMT2APARP10POLBGLA | |
| SCHEMBL609237 | 0.78 | LTA4H (0.44) | KMT2APARP10POLBALDH1A1GAA |
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-2008079610-A2 | NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME | ABBOTT LABORATORIES (US) | 2008-07-03 | — | — | WO | disclosed |