Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | HTR6 | P50406 | 3/20 | 0.50 |
| ▸ | ACVR1 | Q04771 | 5/20 | 0.48 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.45 |
| ▸ | HTR3B | O95264 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 2/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1741562 | 0.83 | ADRB1 (0.61) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL3633976 | 0.83 | ACVR1 (0.62) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL30798753 | 0.83 | ADRB1 (0.61) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| Hydrochloric Acid SCHEMBL27825221 | 0.82 | ACVR1 (0.61) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL13818340 | 0.81 | PRKDC (0.56) | MAPTIP6K1 | |
| SCHEMBL2313915 | 0.81 | MAPT (0.55) | MAPTRECQLHTR6ALDH1A1HSD17B10 | |
| SCHEMBL29138207 | 0.80 | ADRB1 (0.61) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL2786892 | 0.80 | SYK (0.46) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL3514309 | 0.79 | MAPT (0.47) | MAPTRECQLHTR6ACVR1TGFBR1 | |
| SCHEMBL29960965 | 0.79 | ACVR1 (0.50) | MAPTRECQLHTR6ACVR1TGFBR1 |
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-117843590-A | 3-amino-4- (piperazin-1-yl) benzamide derivative, pharmaceutical composition containing same, and preparation method and application thereof | 中国药科大学 | 2024-04-09 | — | — | CN | disclosed |