Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 6/20 | 0.43 |
| ▸ | AMY1A | P0DUB6 | 5/20 | 0.40 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2362184 | 0.93 | AMY1A (0.42) | PTGESAMY1AAGPAT2ORAI1DGAT1 | |
| SCHEMBL2364692 | 0.81 | KDM4E (0.45) | PTGESAMY1AAGPAT2CYP2C9CYP2D6 | |
| SCHEMBL2361234 | 0.79 | PTGES (0.45) | PTGESAMY1ACYP2C9ORAI1CYP2D6 | |
| SCHEMBL2361306 | 0.76 | AMY1A (0.44) | PTGESAMY1AORAI1DGAT1PDE7A | |
| SCHEMBL2361250 | 0.75 | AMY1A (0.43) | PTGESAMY1ACYP2C9ORAI1CYP2D6 | |
| SCHEMBL2361475 | 0.74 | DGAT1 (0.43) | PTGESAMY1ACYP2C9ORAI1CYP2D6 | |
| SCHEMBL14146871 | 0.73 | PTGES (0.47) | PTGESCYP2C9CYP2D6 | |
| SCHEMBL2361888 | 0.73 | AMY1A (0.47) | PTGESAMY1ACYP2C9ORAI1CYP2D6 | |
| SCHEMBL2361085 | 0.73 | AMY1A (0.44) | PTGESAMY1AORAI1DGAT1PDE7A | |
| SCHEMBL2362277 | 0.71 | PLAU (0.51) | AMY1ADGAT1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011099832-A2 | NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | CRYSTALGENOMICS, INC. (KR) | 2011-08-18 | — | — | WO | disclosed |