Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | GBA1 | P04062 | 1/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | PRKCG | P05129 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | PRKCB | P05771 | 1/20 | 0.55 |
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7547707 | 0.86 | ESR1 (0.60) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL7547715 | 0.86 | ESR1 (0.60) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL9097407 | 0.85 | ESR1 (0.56) | ESR1CYP19A1ESR2HTR6ESRRG | |
| SCHEMBL9097423 | 0.85 | ESR1 (0.56) | ESR1CYP19A1ESR2HTR6ESRRG | |
| SCHEMBL10798818 | 0.85 | ESR1 (0.59) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL10798831 | 0.85 | ESR1 (0.59) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL25407318 | 0.82 | ESR1 (0.71) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL1962745 | 0.82 | ESR1 (0.59) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL227233 | 0.82 | ESR1 (0.59) | ESR1CYP19A1CYP3A4ESR2MAPT | |
| SCHEMBL10780099 | 0.79 | PTGS2 (0.76) | ESR1CYP19A1CYP3A4ESR2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6489481-B1 | COMPOUNDS USED FOR TREATMENT AND/OR PREVENTION OF NEURONAL APOPTOSIS AND/OR EXCITOTOXICITY RELATED NEUROLOGICAL DISORDERS | ASTRAZENECA AB (SE) | 2002-12-03 | — | — | US | disclosed |
| EP-1127045-A2 | USE OF TRIPHENYLBUTENE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS | AstraZeneca AB (SE) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025767-A2 | USE OF TRIPHENYLBUTENE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS | ASTRAZENECA AB (SE) | 2000-05-11 | — | — | WO | disclosed |