Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | GHSR | Q92847 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | CTSG | P08311 | 1/20 | 0.31 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.31 |
| ▸ | CMA1 | P23946 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2895920 | 1.00 | HDAC3 (0.33) | HDAC3HDAC1HDAC2CYP1A2CYP3A4 | |
| SCHEMBL7159714 | 1.00 | HDAC3 (0.33) | HDAC3HDAC1HDAC2CYP1A2CYP3A4 | |
| SCHEMBL20604058 | 1.00 | HDAC3 (0.33) | HDAC3HDAC1HDAC2CYP1A2CYP3A4 | |
| SCHEMBL2918854 | 0.90 | GHSR (0.33) | HDAC3HDAC1HDAC2CYP1A2CYP3A4 | |
| SCHEMBL7954072 | 0.88 | CNR1 (0.37) | CYP2C9CYP2C19CNR1CNR2GAA | |
| SCHEMBL1028982 | 0.84 | CYP1A2 (0.33) | CYP1A2CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL17328900 | 0.83 | PRSS1 (0.35) | HDAC3HDAC1HDAC2PRSS1CTSG | |
| SCHEMBL4595231 | 0.83 | PRSS1 (0.35) | HDAC3HDAC1HDAC2PRSS1CTSG | |
| SCHEMBL1028989 | 0.81 | CYP1A2 (0.34) | CYP1A2CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL28975264 | 0.80 | PDE5A (0.36) | CYP2C9CYP2C19CNR1CNR2GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-20030113605-A1 | Polymer electrolyte composition and fuel cell | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-06-19 | — | — | US | disclosed |