Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 0.59 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.59 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.59 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.59 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.49 |
| ▸ | CSF1R | P07333 | 2/20 | 0.49 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.49 |
| ▸ | OGA | O60502 | 1/20 | 0.46 |
| ▸ | OXTR | P30559 | 8/20 | 0.46 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.46 |
| ▸ | LCAT | P04180 | 1/20 | 0.43 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21396905 | 0.85 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3NTRK1 | |
| SCHEMBL23498251 | 0.84 | CHRNB2 (0.57) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| SCHEMBL4393507 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| SCHEMBL785009 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| SCHEMBL4391755 | 0.82 | CHRNB2 (0.58) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| Hydrochloric Acid SCHEMBL21384628 | 0.81 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| Hydrochloric Acid SCHEMBL30574425 | 0.81 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3OGA | |
| SCHEMBL26094391 | 0.81 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3LCAT | |
| SCHEMBL14528866 | 0.81 | L3MBTL3 (0.58) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL5312452 | 0.80 | CHRNB2 (0.72) | CHRNB2CHRNA4CHRNB4CHRNA3OGA |
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-2019179362-A1 | AMIDINE AND GUANIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICAL USES THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-09-26 | — | — | WO | disclosed |