Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 9/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 5/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.36 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27317071 | 0.79 | KMT2A (0.49) | CYP2C9PARP10PARP15PARP2CYP2C19 | |
| SCHEMBL5740392 | 0.77 | KDM1A (0.36) | ALDH1A1KMT2AMAPTKDM1AMAOA | |
| Ammonia Solution, Strong SCHEMBL11135718 | 0.74 | CYP2C9 (0.44) | CYP2C9PARP10PARP15PARP2CYP2C19 | |
| SCHEMBL2762400 | 0.66 | CYP2C9 (0.69) | CYP2C9PARP10PARP15PARP2CYP2C19 | |
| Terephthalamide SCHEMBL23774 | 0.66 | PARP1 (0.71) | PARP10PARP15PARP2CYP2C19PARP4 | |
| Hydrochloric Acid SCHEMBL28200483 | 0.65 | CYP2C9 (0.67) | CYP2C9PARP10PARP15PARP2CYP2C19 | |
| SCHEMBL2837223 | 0.65 | CYP2C9 (0.61) | CYP2C9PARP10PARP15PARP2CYP2C19 | |
| Terephthalamide SCHEMBL472214 | 0.64 | PARP1 (0.60) | PARP10PARP15PARP2CYP2C19PARP4 | |
| Terephthalamide SCHEMBL8931235 | 0.64 | PARP1 (0.60) | PARP10PARP15PARP2CYP2C19PARP4 | |
| Terephthalamide SCHEMBL197479 | 0.64 | PARP1 (0.60) | PARP10PARP15PARP2CYP2C19PARP4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007523865-A | — | — | 2007-08-23 | — | — | JP | claimed |
| EP-1646621-A2 | NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN | Abbott Laboratories (US) | 2006-04-19 | — | — | EP | claimed |
| WO-2005007642-A2 | NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN | ABBOTT LABORATORIES (US) | 2005-01-27 | — | — | WO | claimed |