Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 6/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 6/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 6/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 6/20 | 0.35 |
| ▸ | POLB | P06746 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16783100 | 0.83 | STIM1 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4POLB | |
| SCHEMBL16783094 | 0.81 | CRACR2A (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4HSD17B10 | |
| SCHEMBL16804986 | 0.78 | HPGD (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4POLB | |
| SCHEMBL16783020 | 0.70 | PDE4B (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4POLB | |
| SCHEMBL16783097 | 0.70 | STIM1 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4POLB | |
| SCHEMBL16782972 | 0.69 | NPY5R (0.41) | KDM4E | |
| SCHEMBL16782962 | 0.68 | STIM1 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4KDM4E | |
| SCHEMBL16782960 | 0.67 | PDE4D (0.44) | CHRNB2CHRNB4CHRNA3CHRNA4HPGD | |
| SCHEMBL16782983 | 0.67 | STIM1 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| SCHEMBL17376773 | 0.67 | STIM1 (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015090579-A1 | PYRAZOLYL-BASED CARBOXAMIDES IV | Grünenthal GmbH (DE) | 2015-06-25 | — | — | WO | disclosed |