Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | MAT2A | P31153 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17972850 | 1.00 | TAAR1 (0.42) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL17972846 | 0.84 | ALDH1A1 (0.41) | TAAR1ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL802985 | 0.83 | GAA (0.41) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL21718832 | 0.79 | TAAR1 (0.38) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL8489151 | 0.79 | GAA (0.40) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL6965813 | 0.79 | TAAR1 (0.47) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL18494712 | 0.76 | TAAR1 (0.40) | TAAR1GAAMAPTRAB9ANPSR1 | |
| SCHEMBL29449840 | 0.76 | NOTUM (0.43) | TAAR1GAABACE1ALDH1A1LMNA | |
| SCHEMBL936662 | 0.76 | NOTUM (0.43) | TAAR1GAABACE1ALDH1A1LMNA | |
| SCHEMBL8388477 | 0.75 | TSHR (0.46) | ALDH1A1LMNAHPGDMEN1KMT2A |
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-117222628-A | Compound for inhibiting apoptosis and preparation method thereof | 中国科学院上海有机化学研究所 | 2023-12-12 | — | — | CN | disclosed |