Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 12/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27850347 | 0.80 | CYP19A1 (0.58) | ALDH1A1LMNACYP19A1HRH4NPC1 | |
| SCHEMBL27958968 | 0.75 | CYP19A1 (0.59) | ALDH1A1LMNACYP19A1NPC1RAB9A | |
| SCHEMBL6205740 | 0.74 | ALDH1A1 (0.53) | ALDH1A1LMNACYP19A1NPC1RAB9A | |
| SCHEMBL23038469 | 0.73 | ALDH1A1 (0.52) | ALDH1A1LMNACYP19A1PTGS2NPC1 | |
| SCHEMBL28103690 | 0.73 | CYP19A1 (0.51) | ALDH1A1LMNACYP19A1HRH4NPC1 | |
| SCHEMBL25836759 | 0.72 | ALDH1A1 (0.51) | ALDH1A1LMNACYP19A1PTGS2NPC1 | |
| SCHEMBL9290483 | 0.71 | CYP19A1 (0.61) | ALDH1A1LMNACYP19A1HRH4NPC1 | |
| SCHEMBL9288129 | 0.71 | CYP19A1 (0.61) | ALDH1A1LMNACYP19A1HRH4NPC1 | |
| SCHEMBL22510634 | 0.70 | CYP19A1 (0.82) | ALDH1A1LMNACYP19A1PTGS2NPC1 | |
| SCHEMBL25397943 | 0.70 | ALDH1A1 (0.48) | ALDH1A1LMNACYP19A1PTGS2NPC1 |
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-117956985-A | Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof | 梅兹治疗公司 | 2024-04-30 | — | — | CN | disclosed |