Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8544763 | 0.90 | ALDH1A1 (0.55) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL5483975 | 0.84 | HTR1A (0.56) | ALDH1A1LMNAHTR1AADRA1DADRA1A | |
| SCHEMBL17616584 | 0.83 | ALDH1A1 (0.49) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL17616609 | 0.82 | NPC1 (0.57) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL17616586 | 0.82 | NPC1 (0.53) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23680093 | 0.81 | CDK4 (0.56) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL17616587 | 0.80 | NPC1 (0.60) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23680092 | 0.79 | CDK4 (0.41) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19717824 | 0.79 | ALDH1A1 (0.55) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23679909 | 0.78 | CDK4 (0.43) | ALDH1A1LMNACYP1A2CYP2D6CYP2C9 |
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-3613735-B1 | NOVEL SIRT 1 ACTIVATOR AND MEDICINAL USE THEREOF | NAT UNIV PUSAN IND UNIV COOP FOUND (KR) | 2023-04-12 | — | — | EP | disclosed |
| EP-3613735-A1 | NOVEL SIRT 1 ACTIVATOR AND MEDICINAL USE THEREOF | Pusan National University Industry - University Cooperation Foundation (KR) | 2020-02-26 | — | — | EP | disclosed |