Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 8/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.35 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.35 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15261680 | 0.79 | ALDH1A1 (0.41) | PPARACYP3A4ALDH1A1TSHRCYP1A2 | |
| SCHEMBL3948925 | 0.77 | PPARA (0.47) | PPARACYP3A4TSHRCYP1A2MAPT | |
| SCHEMBL4000649 | 0.77 | PPARA (0.47) | PPARACYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL2668320 | 0.76 | PPARA (0.40) | PPARACYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL3233909 | 0.75 | KMT2A (0.47) | PPARACYP3A4TSHRCYP1A2MAPT | |
| SCHEMBL5693949 | 0.75 | KMT2A (0.53) | CYP3A4TDP1ALDH1A1TSHRMAPT | |
| SCHEMBL25298144 | 0.75 | KDM4E (0.40) | PPARAALDH1A1TSHRCYP1A2MAPT | |
| SCHEMBL30496650 | 0.75 | KDM4E (0.40) | PPARAALDH1A1TSHRCYP1A2MAPT | |
| SCHEMBL2668282 | 0.75 | PPARA (0.46) | PPARACYP3A4ALDH1A1TSHRCYP1A2 | |
| SCHEMBL15271467 | 0.75 | CYP3A4 (0.48) | PPARACYP3A4ALDH1A1TSHRMAPT |
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-0912513-A1 | FIBRINOGEN RECEPTOR ANTAGONIST PRODRUGS | Merck & Co., Inc. (US) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998000401-A1 | FIBRINOGEN RECEPTOR ANTAGONIST PRODRUGS | MERCK & CO., INC. (US) | 1998-01-08 | — | — | WO | disclosed |