Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.41 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.41 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27820751 | 0.95 | GSK3B (0.44) | GSK3BCDK2CYP17A1MAPK14TUBB4A | |
| SCHEMBL27820756 | 0.91 | GSK3B (0.47) | GSK3BCDK2CYP17A1HDAC1HDAC6 | |
| SCHEMBL28807093 | 0.88 | HDAC1 (0.48) | HDAC1HDAC6TUBB4ATUBBTUBA3C | |
| SCHEMBL15664662 | 0.87 | TUBB4A (0.55) | GSK3BCDK2CYP17A1HDAC1HDAC6 | |
| SCHEMBL27820749 | 0.86 | GSK3B (0.48) | GSK3BCDK2CYP17A1HDAC1HDAC6 | |
| SCHEMBL15665220 | 0.86 | GSK3B (0.48) | GSK3BCDK2CYP17A1HDAC1HDAC6 | |
| SCHEMBL15665361 | 0.86 | GSK3B (0.46) | GSK3BCDK2CYP17A1HDAC1HDAC6 | |
| SCHEMBL15664738 | 0.84 | DPP4 (0.46) | HDAC1HDAC6TUBB4ATUBBTUBA3C | |
| SCHEMBL15664335 | 0.84 | ALDH1A1 (0.43) | HDAC1HDAC6TUBB4ATUBBTUBA3C | |
| SCHEMBL15665191 | 0.84 | MAPK14 (0.39) | GSK3BCDK2HDAC1HDAC6MAPK14 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102863388-B | Tumor targeted drug Combretastatin A4 derivatives | NANJING SANHOME PHARMACEUTICAL CO LTD | 2015-04-29 | — | — | CN | claimed |
| CN-102190625-B | Stilbene tumor targeted medicine Combretastatin A4 analogs | NANJING SANHOME PHARMACEUTICAL CO LTD | 2013-08-28 | — | — | CN | claimed |
| CN-102190625-B | Stilbene tumor targeted medicine Combretastatin A4 analogs | NANJING SANHOME PHARMACEUTICAL CO LTD | 2013-08-28 | — | — | CN | disclosed |