Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | MAOB | P27338 | 12/20 | 0.58 |
| ▸ | MAOA | P21397 | 6/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8773392 | 1.00 | ALDH1A1 (0.59) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| Hydrogen Sulfide SCHEMBL27855781 | 0.82 | CA12 (0.44) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL5013425 | 0.81 | ALDH1A1 (0.58) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL27700653 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL16982170 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL11564497 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL9056199 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL29116198 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL5013421 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAOBMAOACYP3A4CYP2D6 | |
| SCHEMBL11513004 | 0.78 | MAOB (0.67) | ALDH1A1MAOBMAOACYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20240034799-A1 | METHODS AND SYSTEMS OF STRATIFYING INFLAMMATORY DISEASE PATIENTS | CEDARS SINAI MEDICAL CENTER (US) | 2024-02-01 | — | — | US | disclosed |
| US-20230279491-A1 | TREATMENTS FOR A SUB-POPULATION OF INFLAMMATORY BOWEL DISEASE PATIENTS | CEDARS-SINAI MEDICAL CENTER | 2023-09-07 | — | — | US | disclosed |