Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6440445 | 0.91 | CNR2 (0.53) | ALDH1A1CYP3A4CNR2HDAC1HDAC8 | |
| SCHEMBL6440804 | 0.88 | ESR2 (0.62) | ALDH1A1CYP3A4GAAHDAC1HDAC8 | |
| SCHEMBL6439260 | 0.84 | CNR2 (0.63) | ALDH1A1CNR2HDAC1HDAC8HDAC6 | |
| SCHEMBL6441068 | 0.83 | CNR2 (0.62) | ALDH1A1CNR2HDAC1HDAC8HDAC6 | |
| SCHEMBL6470830 | 0.82 | HPGDS (0.48) | ALDH1A1CYP3A4GAAHDAC1HDAC8 | |
| SCHEMBL6912346 | 0.80 | ALDH1A1 (0.67) | ALDH1A1GAACNR2HDAC1HDAC8 | |
| SCHEMBL6439734 | 0.80 | ESR2 (0.60) | ALDH1A1CYP3A4GAACNR2NPSR1 | |
| SCHEMBL6438788 | 0.79 | ESR2 (0.62) | ALDH1A1GAACNR2HDAC1HDAC8 | |
| SCHEMBL6439028 | 0.79 | ESR1 (0.67) | ALDH1A1CYP3A4GAACNR2HDAC1 | |
| SCHEMBL30746859 | 0.79 | ESR1 (0.67) | ALDH1A1CYP3A4GAACNR2HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1517897-A2 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS ESTROGEN AGONISTS/ANTAGONISTS | Pfizer Products Inc. (US) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004000817-A2 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS ESTROGEN AGONISTS/ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2003-12-31 | — | — | WO | disclosed |