Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 2/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.50 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5479473 | 0.86 | HCRTR2 (0.52) | ALDH1A1NR1I2MAPK1USP2KEAP1 | |
| SCHEMBL7422328 | 0.83 | KMT2A (0.64) | ALDH1A1NR1I2MAPK1KEAP1NFE2L2 | |
| SCHEMBL6318614 | 0.82 | ALDH1A1 (0.48) | ALDH1A1USP2TSHRLMNAPTPN1 | |
| SCHEMBL5624368 | 0.82 | LMNA (0.45) | ALDH1A1HCRTR2TSHRLMNAPTPN1 | |
| SCHEMBL3462930 | 0.82 | HCRTR2 (0.53) | ALDH1A1NR1I2MAPK1KEAP1NFE2L2 | |
| SCHEMBL6573645 | 0.81 | KEAP1 (0.48) | ALDH1A1KEAP1NFE2L2HCRTR2 | |
| SCHEMBL7000752 | 0.81 | KEAP1 (0.66) | ALDH1A1MAPK1KEAP1NFE2L2LMNA | |
| SCHEMBL7003143 | 0.79 | KEAP1 (0.71) | ALDH1A1KEAP1NFE2L2HCRTR2LMNA | |
| SCHEMBL1732616 | 0.78 | SMN1; SMN2 (0.49) | ALDH1A1MAPK1USP2HCRTR2TSHR | |
| SCHEMBL27599056 | 0.78 | SMN1; SMN2 (0.49) | ALDH1A1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885205-A4 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 2002-11-27 | — | — | EP | disclosed |
| EP-0885205-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-12-23 | — | — | EP | disclosed |
| US-5780480-A | THROMBOLYTIC AGENTS, ANTICOAGULANTS | MERCK & CO., INC. (US) | 1998-07-14 | — | — | US | disclosed |
| WO-1997031910-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-09-04 | — | — | WO | disclosed |