Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19897711 | 1.00 | NLRP3 (0.51) | NLRP3HPGDHTTALOX5HCRTR1 | |
| SCHEMBL30394063 | 0.96 | HPGD (0.50) | NLRP3HPGDHTTALOX5HCRTR1 | |
| SCHEMBL19897775 | 0.96 | HPGD (0.50) | NLRP3HPGDHTTALOX5HCRTR1 | |
| SCHEMBL30395214 | 0.90 | MAPT (0.47) | NLRP3HPGDHTTALOX5TSHR | |
| SCHEMBL18729343 | 0.90 | MAPT (0.47) | NLRP3HPGDHTTALOX5TSHR | |
| SCHEMBL449455 | 0.83 | LMNA (0.56) | NLRP3HPGDHTTALOX5SIGMAR1 | |
| SCHEMBL447886 | 0.81 | HTT (0.48) | NLRP3HPGDHTTALOX5SMN1; SMN2 | |
| SCHEMBL31055402 | 0.78 | HPGD (0.54) | NLRP3HPGDHTTSMN1; SMN2MAPT | |
| SCHEMBL30577136 | 0.77 | SMN1; SMN2 (0.46) | HPGDHTTSMN1; SMN2MAPTRAB9A | |
| SCHEMBL28616072 | 0.77 | SMN1; SMN2 (0.46) | HPGDHTTSMN1; SMN2MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109863146-B | Biaryl compounds as immunomodulators | 百时美施贵宝公司 | 2023-02-28 | — | — | CN | disclosed |