Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM6B | O15054 | 1/20 | 0.39 |
| ▸ | TET3 | O43151 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM5C | P41229 | 1/20 | 0.39 |
| ▸ | ASPH | Q12797 | 1/20 | 0.39 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.39 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.39 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.39 |
| ▸ | KDM7A | Q6ZMT4 | 1/20 | 0.39 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.39 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.39 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.39 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6425243 | 0.95 | KDM4E (0.42) | KDRKDM4EALDH1A1KDM6BTET3 | |
| SCHEMBL29834690 | 0.95 | KDM4E (0.42) | KDRKDM4EALDH1A1KDM6BTET3 | |
| Methylamine SCHEMBL28986184 | 0.92 | PYGL (0.41) | KDRKDM4EALDH1A1KDM6BTET3 | |
| SCHEMBL400969 | 0.84 | RAF1 (0.47) | KDRBRAFP2RX3GRM5RAF1 | |
| SCHEMBL28790568 | 0.82 | NR4A1 (0.53) | KDRKDM4EALDH1A1KDM6BTET3 | |
| SCHEMBL28407666 | 0.81 | GRM5 (0.44) | KDRPYGLPYGMBRAFGRM5 | |
| SCHEMBL28986164 | 0.81 | KDR (0.38) | KDRBRAFGRM5RAF1RIPK2 | |
| SCHEMBL29834761 | 0.81 | P2RX3 (0.43) | KDRALDH1A1PYGLPYGMBRAF | |
| SCHEMBL4328868 | 0.81 | P2RX3 (0.43) | KDRALDH1A1PYGLPYGMBRAF | |
| SCHEMBL28407664 | 0.80 | GRM5 (0.40) | KDRPYGLPYGMBRAFGRM5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116392484-A | Coated pharmaceutical composition containing regorafenib | 拜尔健康护理有限责任公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-116392485-A | Coated pharmaceutical composition containing regorafenib | 拜尔健康护理有限责任公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-116392598-A | Coated pharmaceutical composition containing regorafenib | 拜尔健康护理有限责任公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-115991673-A | Purification method of regorafenib | 四川科伦药物研究院有限公司 | 2023-04-21 | — | — | CN | disclosed |