Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | HTR1B | P28222 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10703868 | 0.81 | THRB (0.41) | KCNA3THRBLTA4HHTR1BLMNA | |
| SCHEMBL97622 | 0.80 | KCNA3 (0.41) | KCNA3LTA4HHTR1BLMNAHTR1D | |
| SCHEMBL27874624 | 0.77 | KCNA3 (0.46) | KCNA3LTA4HHTR1BLMNAHTR1D | |
| SCHEMBL677488 | 0.76 | KCNA3 (0.50) | KCNA3LTA4HHTR1BLMNAHTR1D | |
| SCHEMBL2200517 | 0.76 | KCNA3 (0.50) | KCNA3LTA4HHTR1BLMNAHTR1D | |
| SCHEMBL4984322 | 0.76 | KCNA3 (0.50) | KCNA3LTA4HHTR1BLMNAHTR1D | |
| SCHEMBL16613936 | 0.76 | ALDH1A1 (0.42) | KCNA3THRBLTA4HTAAR1ALDH1A1 | |
| SCHEMBL10516249 | 0.74 | MAPT (0.49) | KCNA3THRBLMNAALDH1A1RECQL | |
| SCHEMBL6472344 | 0.73 | TSHR (0.50) | TAAR1ALDH1A1 | |
| SCHEMBL25053084 | 0.72 | KCNA3 (0.46) | KCNA3LTA4HHTR1BLMNAHTR1D |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005012209-A2 | CATALYZED ENANTIOSELECTIVE TRANSFORMATION OF ALKENES | UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2005-02-10 | — | — | WO | claimed |
| WO-2005012209-A2 | CATALYZED ENANTIOSELECTIVE TRANSFORMATION OF ALKENES | UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2005-02-10 | — | — | WO | disclosed |