Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 3/20 | 0.50 |
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 5/20 | 0.43 |
| ▸ | AURKA | O14965 | 3/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.43 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19249350 | 0.78 | MRGPRX4 (0.36) | TDO2RXFP1ROCK2ROCK1 | |
| SCHEMBL19249226 | 0.76 | TDO2 (0.34) | TDO2RXFP1EGFRROCK2ROCK1 | |
| SCHEMBL29721496 | 0.73 | APP (0.48) | TDO2APPRXFP1EGFRRPS6KB1 | |
| SCHEMBL20129864 | 0.73 | APP (0.48) | TDO2APPRXFP1EGFRRPS6KB1 | |
| SCHEMBL19249228 | 0.71 | PTPN5 (0.42) | IDO1PTPN5 | |
| SCHEMBL19249331 | 0.70 | CYP1A2 (0.43) | TDO2EGFRRPS6KB1AURKAAURKB | |
| SCHEMBL18983680 | 0.70 | ALDH1A1 (0.60) | APPRXFP1PTPN5 | |
| SCHEMBL22084443 | 0.69 | BACE1 (0.40) | APPIDO1HDAC1HDAC6 | |
| SCHEMBL27816900 | 0.69 | TSHR (0.56) | TDO2APPRXFP1EGFRRPS6KB1 | |
| SCHEMBL5534504 | 0.69 | RXFP1 (0.56) | TDO2APPRXFP1EGFRRPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017133258-A1 | 1H-INDAZOLE DERIVATIVE AND USE THEREOF AS IDO INHIBITOR | 西华大学 | 2017-08-10 | — | — | WO | disclosed |