Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27937647 | 0.78 | HTT (0.43) | HTTTP53GAACA1CA2 | |
| SCHEMBL7732490 | 0.78 | CYP1A2 (0.40) | HTTTP53GAACYP1A2CYP2C19 | |
| SCHEMBL5623819 | 0.78 | ADRB2 (0.41) | GAACYP1A2CYP2C19CYP2C9IDO1 | |
| SCHEMBL27496185 | 0.76 | ALDH1A1 (0.53) | CYP1A2ALDH1A1MAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL10898417 | 0.76 | GABRA1 (0.54) | GAACA12CA1CA2CA9 | |
| SCHEMBL943534 | 0.74 | MAPT (0.40) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL6029216 | 0.74 | L3MBTL1 (0.43) | GAACA1CA2ALDH1A1MAPT | |
| SCHEMBL265334 | 0.74 | ALDH1A1 (0.50) | GAACYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL11523492 | 0.73 | CYP1A2 (0.39) | CA1CA2CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL1044900 | 0.73 | HTT (0.47) | HTTGAACA12CA1CA2 |
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-5691323-A | BENZIMIDAZOL-2-ONES | MERCK & CO., INC. (US) | 1997-11-25 | — | — | US | disclosed |
| US-5574044-A | BENZIMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF MYOPIA | MERCK & CO., INC. (US) | 1996-11-12 | — | — | US | disclosed |
| WO-1996013262-A1 | MUSCARINE ANTAGONISTS | MERCK & CO., INC. (US) | 1996-05-09 | — | — | WO | disclosed |