Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10578951 | 0.99 | BRD4 (0.53) | BRD4EPHX2NR1H4MAP2K1MAPT | |
| SCHEMBL29366872 | 0.86 | BRD4 (0.56) | BRD4ALDH1A1TDP1P2RX7KDM4E | |
| SCHEMBL7614881 | 0.86 | BRD4 (0.56) | BRD4ALDH1A1TDP1P2RX7KDM4E | |
| SCHEMBL10576279 | 0.84 | BRD4 (0.54) | BRD4MAPTALDH1A1P2RX7ATM | |
| SCHEMBL11195728 | 0.84 | BRD4 (0.54) | BRD4MAP2K1SMN1; SMN2ALDH1A1P2RX7 | |
| SCHEMBL10458950 | 0.84 | BRD4 (0.42) | BRD4MAP2K1ALDH1A1 | |
| SCHEMBL10736786 | 0.84 | BRD4 (0.52) | BRD4EPHX2NR1H4MAP2K1MAPT | |
| SCHEMBL10556087 | 0.83 | BRD4 (0.47) | BRD4MAP2K1 | |
| Hydrochloric Acid SCHEMBL10739773 | 0.83 | BRD4 (0.51) | BRD4EPHX2NR1H4MAP2K1MAPT | |
| SCHEMBL29156115 | 0.82 | BRD4 (0.53) | BRD4ALDH1A1TDP1P2RX7KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4892578-A | Phenylmethyl-4,4-dimethyl-3-isoxazolidinone plant regulators | FMC CORPORATION (US) | 1990-01-09 | — | — | US | disclosed |
| US-4839469-A | WET- AND LIGHT-FAST BLUE DYES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-06-13 | — | — | US | disclosed |
| US-4826527-A | Aminophenylmethyl isoxazolidinones as plant regulators | FMC CORPORATION (US) | 1989-05-02 | — | — | US | disclosed |
| US-4552585-A | Herbicidal 2-(aminophenyl)methyl derivatives of 3-isoxazolidinones or 3-oxazinones | FMC CORPORATION (US) | 1985-11-12 | — | — | US | disclosed |