Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 9/20 | 0.57 |
| ▸ | CHRNA4 | P43681 | 9/20 | 0.57 |
| ▸ | CHRNA7 | P36544 | 7/20 | 0.57 |
| ▸ | CHRNA5 | P30532 | 3/20 | 0.57 |
| ▸ | ELANE | P08246 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7276038 | 0.79 | CHRNB2 (0.58) | CHRNB2CHRNA4CHRNA7CHRNA5 | |
| SCHEMBL8804474 | 0.77 | KDM4E (0.55) | CHRNB2CHRNA4ELANEKDM4EHTR3E | |
| SCHEMBL6946846 | 0.75 | HTR4 (0.52) | HTR3ACHRM3 | |
| SCHEMBL6705737 | 0.75 | ELANE (0.70) | ELANEKDM4E | |
| SCHEMBL7276531 | 0.74 | CNR1 (0.56) | CHRNB2CHRNA4CHRNA7CHRNA5ALDH1A1 | |
| SCHEMBL7271018 | 0.74 | CNR1 (0.57) | CHRNB2CHRNA4CHRNA7CHRNA5 | |
| SCHEMBL7271039 | 0.73 | CYP2D6 (0.60) | CHRNB2CHRNA4CHRNA7CHRNA5HTR3E | |
| SCHEMBL7269463 | 0.73 | CYP2D6 (0.60) | CHRNB2CHRNA4CHRNA7CHRNA5HTR3E | |
| SCHEMBL7269469 | 0.73 | CYP2D6 (0.60) | CHRNB2CHRNA4CHRNA7CHRNA5HTR3E | |
| SCHEMBL7277894 | 0.72 | CYP2D6 (0.62) | CHRNB2CHRNA4CHRNA7CHRNA5HTR3E |
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-0499995-B1 | Piperidine derivatives | NISSHIN FLOUR MILLING CO (JP) | 1997-01-02 | — | — | EP | disclosed |
| US-5246945-A | 5-hydroxytryptamine antagonist for nervous system disorders | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1993-09-21 | — | — | US | disclosed |
| EP-0499995-A2 | Piperidine derivatives | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1992-08-26 | — | — | EP | disclosed |