Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.31 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL988369 | 0.84 | TSHR (0.43) | ALDH1A1TSHRACHE | |
| SCHEMBL16537644 | 0.82 | ALDH1A1 (0.41) | TP53NR1H2NR1H3KDM4EALDH1A1 | |
| SCHEMBL21271563 | 0.82 | — | — | |
| SCHEMBL10419089 | 0.82 | TAAR1 (0.32) | — | |
| SCHEMBL9775405 | 0.82 | ALDH1A1 (0.39) | ALDH1A1TSHR | |
| SCHEMBL9775425 | 0.82 | TSHR (0.41) | TP53ALDH1A1HPGDTSHR | |
| SCHEMBL2131460 | 0.80 | — | — | |
| SCHEMBL21271554 | 0.78 | — | — | |
| SCHEMBL15637986 | 0.78 | CA1 (0.50) | TP53ALDH1A1GAATSHR | |
| SCHEMBL30114552 | 0.78 | CA1 (0.50) | TP53ALDH1A1GAATSHR |
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-1232163-B1 | PRODUCTION OF DISUBSTITUTED PENTAFULVENS VIA LITHIATED SILYL-(HALO)ARENE INTERMEDIATES | ALBEMARLE CORP (US) | 2003-05-02 | — | — | EP | disclosed |
| EP-1232163-A1 | PRODUCTION OF DISUBSTITUTED PENTAFULVENS VIA LITHIATED SILYL-(HALO)ARENE INTERMEDIATES | ALBEMARLE CORPORATION (US) | 2002-08-21 | — | — | EP | disclosed |
| WO-2001038333-A1 | PRODUCTION OF DISUBSTITUTED PENTAFULVENS VIA LITHIATED SILYL-(HALO)ARENE INTERMEDIATES | ALBEMARLE CORPORATION (US) | 2001-05-31 | — | — | WO | disclosed |
| US-6084117-A | Production of silated haloarenes by selective silylation of polyhaloarenes | ALBEMARLE CORPORATION (US) | 2000-07-04 | — | — | US | disclosed |