Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.45 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2859651 | 0.89 | MAPT (0.46) | NPSR1MAPTNPC1RAB9AHTT | |
| SCHEMBL2856049 | 0.85 | ATM (0.53) | NPSR1TSHRMAPTNPC1RAB9A | |
| SCHEMBL2858533 | 0.83 | ATM (0.47) | PTGS1PTGS2NPSR1TSHRCYP1A2 | |
| SCHEMBL2850834 | 0.82 | NTRK1 (0.45) | PTGS1PTGS2NPSR1TSHRCYP1A2 | |
| SCHEMBL2850337 | 0.81 | MAPT (0.40) | PTGS1PTGS2NPSR1TSHRCYP1A2 | |
| SCHEMBL2858063 | 0.80 | MAPT (0.57) | NPSR1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2856664 | 0.80 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19MAPTNPC1 | |
| SCHEMBL2859797 | 0.80 | MAPT (0.49) | NPSR1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2850038 | 0.79 | MAPT (0.46) | NPSR1TSHRMAPTNPC1RAB9A | |
| SCHEMBL2854156 | 0.77 | ROCK2 (0.46) | NPSR1TSHRCYP1A2CYP3A4CYP2C19 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |