Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28353839 | 0.84 | TSHR (0.52) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL20610672 | 0.84 | TSHR (0.52) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL10497226 | 0.84 | TDP1 (0.62) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL1415252 | 0.84 | TDP1 (0.62) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL7567511 | 0.84 | TDP1 (0.62) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL14677026 | 0.83 | TSHR (0.50) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL14677020 | 0.83 | TSHR (0.50) | TSHRCYP2C19POLBCYP3A4PARP1 | |
| SCHEMBL13731489 | 0.82 | F7 (0.56) | CYP3A4TDP1GAAALDH1A1LMNA | |
| SCHEMBL13731493 | 0.82 | F7 (0.56) | CYP3A4TDP1GAAALDH1A1LMNA | |
| SCHEMBL4744665 | 0.82 | TSHR (0.54) | TSHRCYP2C19POLBCYP3A4PARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1556032-A1 | AGENT FOR PREVENTING OR TREATING NEUROPATHY | Takeda Pharmaceutical Company Limited (JP) | 2005-07-27 | — | — | EP | disclosed |
| WO-2004039365-A1 | AGENT FOR PREVENTING OR TREATING NEUROPATHY | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2004-05-13 | — | — | WO | disclosed |