Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 6/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8635431 | 0.95 | TP53 (0.43) | TP53KDM4ETSHRMAPK1ALDH1A1 | |
| SCHEMBL8627411 | 0.93 | TSHR (0.44) | TP53KDM4ETSHRMAPK1ALDH1A1 | |
| SCHEMBL8867663 | 0.90 | TSHR (0.41) | TP53KDM4ETSHRMAPK1ALDH1A1 | |
| SCHEMBL8627942 | 0.83 | TSHR (0.43) | TP53TSHRMAPK1ALDH1A1GAA | |
| SCHEMBL8632930 | 0.82 | TSHR (0.45) | TP53KDM4ETSHRMAPK1ALDH1A1 | |
| SCHEMBL8629030 | 0.79 | TSHR (0.41) | TP53TSHRMAPK1ALDH1A1GAA | |
| SCHEMBL8631498 | 0.77 | TSHR (0.43) | TP53TSHRMAPK1ALDH1A1LMNA | |
| SCHEMBL8632487 | 0.76 | TSHR (0.41) | TP53TSHRMAPK1ALDH1A1GAA | |
| SCHEMBL8604584 | 0.76 | KDM4E (0.45) | TP53KDM4ETSHRMAPK1ALDH1A1 | |
| SCHEMBL25834083 | 0.73 | KDM4E (0.63) | KDM4EMAPK1ALDH1A1GAALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5854242-A | Benzoxazine antimicrobial agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1998-12-29 | — | — | US | disclosed |
| US-5696117-A | BACTERICIDE | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-12-09 | — | — | US | disclosed |