Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.46 |
| ▸ | HCRTR1 | O43613 | 6/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CPS1 | P31327 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6161806 | 1.00 | TRPV1 (0.46) | TRPV1HCRTR1HCRTR2RAB9AMAPT | |
| SCHEMBL6163596 | 1.00 | TRPV1 (0.46) | TRPV1HCRTR1HCRTR2RAB9AMAPT | |
| SCHEMBL6163699 | 0.87 | POLB (0.55) | TRPV1HCRTR1HCRTR2RAB9AMAPT | |
| SCHEMBL6163817 | 0.87 | POLB (0.55) | TRPV1HCRTR1HCRTR2RAB9AMAPT | |
| SCHEMBL6165715 | 0.87 | POLB (0.55) | TRPV1HCRTR1HCRTR2RAB9AMAPT | |
| SCHEMBL6161799 | 0.85 | TRPV1 (0.44) | TRPV1HCRTR1HCRTR2MAPTPOLB | |
| SCHEMBL6163055 | 0.85 | TRPV1 (0.44) | TRPV1HCRTR1HCRTR2MAPTPOLB | |
| SCHEMBL6162249 | 0.85 | TRPV1 (0.44) | TRPV1HCRTR1HCRTR2MAPTPOLB | |
| SCHEMBL6167551 | 0.80 | RAB9A (0.49) | TRPV1HCRTR1HCRTR2RAB9ANTRK1 | |
| SCHEMBL6164221 | 0.80 | TRPV1 (0.50) | TRPV1HCRTR1HCRTR2MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1337523-B1 | 2,4-SUBSTITUTED PYRIDINE DERIVATIVES | NEUROGEN CORP (US) | 2005-10-19 | — | — | EP | claimed |