Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL22339471 | 0.79 | PDK1 (0.37) | — | |
| SCHEMBL31066733 | 0.78 | TSHR (0.41) | LMNATSHRAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL31066664 | 0.77 | TSHR (0.45) | LMNATSHRAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL31066669 | 0.75 | AKR1C3 (0.36) | LMNATSHRAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL25939641 | 0.73 | ALDH1A1 (0.49) | LMNATSHRAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL31066653 | 0.71 | AKR1C3 (0.36) | LMNATSHRAKR1C3AKR1C1ALDH1A1 | |
| SCHEMBL3282634 | 0.71 | TP53 (0.55) | TSHRAKR1C3AKR1C1ALDH1A1KMT2A | |
| SCHEMBL25939514 | 0.71 | TP53 (0.55) | TSHRAKR1C3AKR1C1ALDH1A1KMT2A | |
| SCHEMBL25939640 | 0.71 | TP53 (0.55) | TSHRAKR1C3AKR1C1ALDH1A1KMT2A | |
| SCHEMBL31066650 | 0.71 | TSHR (0.40) | LMNATSHRAKR1C3AKR1C1ALDH1A1 |
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 |