Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 4/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 3/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL377345 | 1.00 | HDAC3 (0.40) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL5176301 | 0.87 | CES1 (0.41) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL5176308 | 0.87 | CES1 (0.41) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL5177367 | 0.87 | CES1 (0.41) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL7666343 | 0.84 | POLB (0.38) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL5285157 | 0.84 | POLB (0.38) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL28283297 | 0.84 | FAAH (0.49) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL28054391 | 0.84 | FAAH (0.49) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL27564543 | 0.84 | FAAH (0.49) | TSHRCES2CES1FAAHMEN1 | |
| SCHEMBL28196445 | 0.84 | FAAH (0.49) | TSHRCES2CES1FAAHMEN1 |
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-106803590-B | A kind of lithium ion battery negative material bonding agent and negative electrode material and lithium battery | 德阳九鼎智远知识产权运营有限公司 | 2019-08-02 | — | — | CN | disclosed |