Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27003510 | 0.69 | ALDH1A1 (0.37) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL25061686 | 0.65 | ALDH1A1 (0.44) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL20643699 | 0.63 | KDM4E (0.33) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL25061694 | 0.62 | GSK3B (0.42) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL24961530 | 0.57 | ALDH1A1 (0.38) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL21500472 | 0.56 | ALDH1A1 (0.41) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL21106026 | 0.52 | LPO (0.38) | ALDH1A1 | |
| SCHEMBL23695312 | 0.51 | ALDH1A1 (0.32) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL1318483 | 0.51 | ALDH1A1 (0.42) | KDM4EHCRTR1ALDH1A1GAAMAPT | |
| SCHEMBL23685867 | 0.47 | ALDH1A1 (0.30) | ALDH1A1 |
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-0411701-A2 | Certain imidazole compounds as transglutaminase inhibitors | MERCK & CO. INC. (US) | 1991-02-06 | — | — | EP | disclosed |
| US-4968713-A | THROMBOLYTIC OR FIBRINOLYTIC THERAPY | MERCK & CO., INC. (US) | 1990-11-06 | — | — | US | disclosed |