Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MC4R | P32245 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | MC3R | P41968 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2143043 | 0.73 | HSP90AA1 (0.41) | HSP90AA1KDM4ENAPRTHCAR2VNN1 | |
| SCHEMBL19399263 | 0.73 | HSP90AA1 (0.36) | HSP90AA1KDM4ENAPRTHCAR2VNN1 | |
| SCHEMBL28127324 | 0.73 | HSP90AA1 (0.36) | HSP90AA1KDM4ENAPRTHCAR2VNN1 | |
| SCHEMBL20508939 | 0.70 | HSP90AA1 (0.33) | HSP90AA1VNN1 | |
| SCHEMBL19779498 | 0.70 | HSP90AA1 (0.38) | HSP90AA1VNN1BAZ2BADORA3TSHR | |
| SCHEMBL31605040 | 0.68 | HSP90AA1 (0.37) | HSP90AA1 | |
| SCHEMBL19398566 | 0.68 | LMNA (0.36) | HSP90AA1KDM4EADORA3TSHRMC4R | |
| SCHEMBL2141892 | 0.68 | VNN1 (0.34) | HSP90AA1VNN1 | |
| SCHEMBL28635906 | 0.68 | KDM4E (0.32) | HSP90AA1KDM4ENAPRTHCAR2VNN1 | |
| SCHEMBL28195064 | 0.68 | POLB (0.34) | HSP90AA1KDM4ENAPRTHCAR2VNN1 |
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-106459029-B | Indolin-2-one or pyrrolo-pyridine -2- ketone derivatives | 豪夫迈·罗氏有限公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-109641854-A | Integration stress access regulator | 卡里科生命科学有限责任公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-109153672-A | TRPV4 antagonist | 葛兰素史密斯克莱知识产权（第2 号）有限公司 | 2019-01-04 | — | — | CN | disclosed |
| CN-105008361-A | Diazepine derivatives useful as calcium channel blockers in the treatment of pain | ABBVIE INC | 2015-10-28 | — | — | CN | disclosed |