Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 13/20 | 0.45 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718635 | 0.87 | PPARA (0.45) | SCN9AALDH1A1MAPK1SMN1; SMN2PPARA | |
| SCHEMBL3726423 | 0.86 | MTNR1A (0.47) | SMN1; SMN2 | |
| SCHEMBL3728857 | 0.84 | STK39 (0.41) | SCN9A | |
| SCHEMBL3720294 | 0.81 | ACACB (0.43) | SCN9ACYP2C9 | |
| SCHEMBL3717756 | 0.80 | SCN9A (0.41) | SCN9ASCN10AALDH1A1PPARAMEN1 | |
| SCHEMBL3720850 | 0.80 | PPARA (0.43) | SCN9AALDH1A1MAPK1SMN1; SMN2PPARA | |
| SCHEMBL3727616 | 0.77 | ESRRA (0.52) | ALDH1A1PPARAMEN1MAPTKMT2A | |
| SCHEMBL3726323 | 0.76 | SMN1; SMN2 (0.43) | SCN9AALDH1A1MAPK1SMN1; SMN2RAB9A | |
| SCHEMBL3718634 | 0.75 | CYP17A1 (0.51) | ALDH1A1CYP2C9 | |
| SCHEMBL3723076 | 0.73 | MTNR1A (0.50) | SCN9AALDH1A1SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | claimed |
| WO-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |