Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31066653 | 0.80 | AKR1C3 (0.36) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL31066652 | 0.78 | LMNA (0.38) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL31066664 | 0.77 | TSHR (0.45) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL31066650 | 0.74 | TSHR (0.40) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL25939641 | 0.73 | ALDH1A1 (0.49) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL4029796 | 0.73 | MAPT (0.50) | TSHRALDH1A1MAPTKDM4ELMNA | |
| SCHEMBL31066651 | 0.72 | TSHR (0.50) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL27713735 | 0.72 | TSHR (0.50) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL3290728 | 0.71 | TSHR (0.53) | TSHRAKR1C3AKR1C1ALDH1A1MAPT | |
| SCHEMBL3282634 | 0.71 | TP53 (0.55) | TSHRAKR1C3AKR1C1ALDH1A1MAPT |
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-113614095-B | Alkylboronic acids as arginase inhibitors | 广东新契生物医药科技有限公司 | 2024-08-23 | — | — | CN | disclosed |