Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7259247 | 0.94 | IDO1 (0.45) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7254334 | 0.93 | IDO1 (0.44) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7255214 | 0.92 | IDO1 (0.43) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7257945 | 0.92 | IDO1 (0.43) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7254326 | 0.85 | KDM4E (0.48) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7255220 | 0.85 | KDM4E (0.48) | IDO1PTGER1CYP2C9MAPTPKM | |
| SCHEMBL7372767 | 0.84 | MAPT (0.58) | IDO1PTGER1CYP2C9MAPTTSHR | |
| SCHEMBL3730313 | 0.84 | MAPT (0.45) | IDO1PTGER1CYP2C9MAPTGAA | |
| SCHEMBL28962997 | 0.83 | IDO1 (0.53) | IDO1PTGER1CYP2C9MAPTALDH1A1 | |
| SCHEMBL7260017 | 0.83 | KDM4E (0.46) | IDO1PTGER1CYP2C9MAPTPKM |
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-2003011222-A2 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2003-02-13 | — | — | WO | disclosed |