Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HK1 | P19367 | 1/20 | 0.35 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 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 | |
|---|---|---|---|---|
| SCHEMBL4052525 | 0.86 | KDM4E (0.41) | KDM4ERXFP1MAPTALDH1A1LMNA | |
| SCHEMBL4055284 | 0.75 | CASP3 (0.36) | KDM4ECASP3RXFP1MAPTALDH1A1 | |
| SCHEMBL4052669 | 0.73 | KDM4E (0.41) | KDM4ERXFP1ALDH1A1HSD17B10KMT2A | |
| SCHEMBL13693825 | 0.70 | KDM4E (0.43) | KDM4ERXFP1MAPTALDH1A1LMNA | |
| SCHEMBL13693826 | 0.70 | ALDH1A1 (0.49) | KDM4ERXFP1ALDH1A1HSD17B10KMT2A | |
| SCHEMBL4053668 | 0.68 | KDM4E (0.39) | KDM4ERXFP1MAPTALDH1A1LMNA | |
| SCHEMBL4055500 | 0.65 | KDM4E (0.39) | KDM4ERXFP1ALDH1A1HSD17B10ATM | |
| SCHEMBL4373659 | 0.65 | CYP19A1 (0.53) | KDM4EMAPTALDH1A1HSD17B10KMT2A | |
| SCHEMBL13693820 | 0.64 | PDE4A (0.41) | KDM4ERXFP1ALDH1A1HSD17B10HTR6 | |
| SCHEMBL8366324 | 0.63 | THRB (0.47) | KDM4ECASP3RXFP1MAPTALDH1A1 |
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-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |