Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.45 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | CCKBR | P32239 | 2/20 | 0.42 |
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13814414 | 0.91 | TACR1 (0.45) | SCN9ATACR1HDAC1HDAC8ACE | |
| SCHEMBL8243903 | 0.87 | CTSL (0.47) | SCN9ATACR1HDAC1HDAC8ACE | |
| SCHEMBL4174694 | 0.84 | CTSL (0.41) | SCN9ATACR1HDAC1HDAC8ACE | |
| SCHEMBL8939524 | 0.81 | SCN9A (0.65) | SCN9ATACR1ACECTSLCTSS | |
| SCHEMBL8939526 | 0.81 | SCN9A (0.65) | SCN9ATACR1ACECTSLCTSS | |
| SCHEMBL31407794 | 0.81 | SCN9A (0.65) | SCN9ATACR1ACECTSLCTSS | |
| SCHEMBL4267961 | 0.79 | SCN9A (0.46) | SCN9ACCKBRMEN1KMT2A | |
| SCHEMBL4108691 | 0.79 | SCN9A (0.46) | SCN9ACCKBRMEN1KMT2A | |
| SCHEMBL31725820 | 0.79 | TACR1 (0.61) | SCN9ATACR1ACECTSLCTSS | |
| SCHEMBL4265005 | 0.78 | SCN9A (0.45) | SCN9ACCKBRMEN1KMT2A |
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-2006134613-A2 | NOVEL 5-SUBSTITUTED INDOLE DERIVATIVES AS DIPEPTIDYL PEPTIDASE IV (DPP-IV) INHIBITORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2006-12-21 | — | — | WO | disclosed |