Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR3 | P32745 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 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 | |
|---|---|---|---|---|
| SCHEMBL13294146 | 1.00 | SSTR3 (0.50) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 | |
| SCHEMBL13758829 | 1.00 | SSTR3 (0.50) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 | |
| SCHEMBL15116511 | 0.94 | SSTR3 (0.46) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 | |
| SCHEMBL19388333 | 0.94 | SSTR3 (0.46) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 | |
| SCHEMBL15116510 | 0.93 | SSTR3 (0.46) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 | |
| SCHEMBL857063 | 0.93 | SSTR3 (0.47) | SSTR3TRPA1AAK1 | |
| SCHEMBL857062 | 0.93 | SSTR3 (0.47) | SSTR3TRPA1AAK1 | |
| SCHEMBL859381 | 0.93 | SSTR3 (0.47) | SSTR3TRPA1AAK1 | |
| SCHEMBL18480468 | 0.93 | SSTR3 (0.58) | SSTR3TRPA1DGAT1MMP1MMP3 | |
| SCHEMBL15125139 | 0.91 | SSTR3 (0.44) | SSTR3TRPA1CYP3A4CYP2C9NR1I2 |
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-2009102318-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-08-20 | — | — | WO | disclosed |