Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | GALR2 | O43603 | 1/20 | 0.52 |
| ▸ | MITF | O75030 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | XBP1 | P17861 | 1/20 | 0.52 |
| ▸ | CCR6 | P51684 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5167381 | 0.94 | SMN1; SMN2 (0.52) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL1965597 | 0.88 | NPSR1 (0.49) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL14854666 | 0.86 | ALDH1A1 (0.60) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL671475 | 0.85 | MAPT (0.55) | SMN1; SMN2LMNAAKR1C2AKR1C1MAPT | |
| SCHEMBL4652737 | 0.84 | MAPT (0.54) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL3251790 | 0.84 | NPSR1 (0.50) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL30748250 | 0.84 | NPSR1 (0.50) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL23070353 | 0.84 | SMN1; SMN2 (0.57) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL7375343 | 0.82 | SLC9A1 (0.61) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 | |
| SCHEMBL4149265 | 0.82 | LMNA (0.48) | SMN1; SMN2NPSR1ALDH1A1LMNAGALR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112707845-B | Preparation method of dacatinib intermediate | 成都伊诺达博医药科技有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-112707845-A | Preparation method of dacomitinib intermediate | 成都伊诺达博医药科技有限公司 | 2021-04-27 | — | — | CN | disclosed |