Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | F2 | P00734 | 2/20 | 0.41 |
| ▸ | PLAU | P00749 | 2/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL4790806 | 0.88 | SCN9A (0.72) | SCN9AADORA1ATMELANEALDH1A1 | |
| SCHEMBL4792382 | 0.87 | SCN9A (0.62) | SCN9AATMELANEALDH1A1KMT2A | |
| SCHEMBL4795594 | 0.87 | SCN9A (0.56) | SCN9AADORA1ATMALDH1A1KMT2A | |
| SCHEMBL4792532 | 0.86 | SCN9A (0.61) | SCN9AADORA1ATMELANEALDH1A1 | |
| SCHEMBL4791726 | 0.84 | SCN9A (0.55) | SCN9AADORA1ATMELANEF2 | |
| SCHEMBL4794092 | 0.81 | SCN9A (0.48) | SCN9AADORA1ATMKMT2AMEN1 | |
| SCHEMBL4794087 | 0.78 | SCN9A (0.42) | SCN9AATMNR3C1NPY5RNPBWR1 | |
| SCHEMBL25678102 | 0.78 | SCN9A (0.44) | SCN9AATMPOLBNR3C1CYP2C9 | |
| SCHEMBL16260376 | 0.76 | SCN9A (0.56) | SCN9AELANEALDH1A1KMT2AMEN1 | |
| SCHEMBL12070101 | 0.76 | SCN9A (0.74) | SCN9AADORA1ELANEALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1937647-A1 | CONDENSED PYRAZOLE DERIVATIVES AS PPAR AGONISTS II | Inpharmatica Limited (GB) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007036727-A1 | CONDENSED PYRAZOLE DERIVATIVES AS PPAR AGONISTS II | INPHARMATICA LIMITED (GB) | 2007-04-05 | — | — | WO | disclosed |
| WO-2007036727-A1 | CONDENSED PYRAZOLE DERIVATIVES AS PPAR AGONISTS II | INPHARMATICA LIMITED (GB) | 2007-04-05 | — | — | WO | disclosed |