Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 8/20 | 0.45 |
| ▸ | CBFB | Q13951 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2645759 | 0.92 | GCK (0.46) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2646999 | 0.88 | GCK (0.42) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2647266 | 0.88 | GCK (0.42) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2646482 | 0.86 | GCK (0.44) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2647362 | 0.86 | CBFB (0.46) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2644784 | 0.85 | GCK (0.43) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2646267 | 0.84 | GCK (0.42) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2644677 | 0.83 | CBFB (0.49) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2644315 | 0.83 | DHODH (0.46) | GCKCBFBALDH1A1TP53CYP3A4 | |
| SCHEMBL2644854 | 0.83 | GCK (0.45) | GCKCBFBALDH1A1TP53CYP3A4 |
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-1702919-B1 | NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE | MSD KK (JP) | 2012-05-30 | — | — | EP | disclosed |
| EP-1702919-A1 | NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2006-09-20 | — | — | EP | disclosed |