Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.40 |
| ▸ | FLT1 | P17948 | 3/20 | 0.40 |
| ▸ | FLT4 | P35916 | 3/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.40 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.40 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.40 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23178053 | 1.00 | HRH3 (0.45) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL23167244 | 1.00 | HRH3 (0.45) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL19897839 | 0.86 | MAOA (0.46) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL30395486 | 0.86 | MAOA (0.46) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL14577983 | 0.78 | CHRNB4 (0.54) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL23178008 | 0.77 | HRH3 (0.39) | HRH3ROCK2ROCK1CDC42BPBCHRNB4 | |
| SCHEMBL29772002 | 0.77 | CHRNB4 (0.56) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL18729042 | 0.77 | RBP4 (0.47) | — | |
| SCHEMBL18729041 | 0.77 | RBP4 (0.47) | — | |
| Hydrochloric Acid SCHEMBL7953408 | 0.76 | HRH3 (0.50) | HRH3CHRNB4CHRNA3EGFRMAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4037776-A1 | COMPOUNDS USEFUL AS IMMUNOMODULATORS | Bristol-Myers Squibb Company (US) | 2022-08-10 | — | — | EP | disclosed |
| CN-114761085-A | Compounds useful as immunomodulators | 百时美施贵宝公司 | 2022-07-15 | — | — | CN | disclosed |