Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | G6PD | P11413 | 1/20 | 0.45 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8392135 | 0.86 | KDM4E (0.49) | CYP3A4MAPK1KDM4ETDP1MAPT | |
| SCHEMBL8388479 | 0.78 | KDM4E (0.49) | KDM4ETDP1MAPTALDH1A1GAA | |
| SCHEMBL27695109 | 0.76 | CYP3A4 (0.54) | CYP3A4MAPK1TDP1ALDH1A1HSD17B10 | |
| SCHEMBL22048288 | 0.73 | SLC6A2 (0.46) | CYP3A4MAPTALDH1A1GAAPOLB | |
| SCHEMBL28985928 | 0.72 | CYP3A4 (0.50) | CYP3A4MAPK1TDP1ALDH1A1HSD17B10 | |
| SCHEMBL9389821 | 0.71 | CYP3A4 (0.54) | CYP3A4MAPK1TDP1MAPTALDH1A1 | |
| SCHEMBL11653027 | 0.69 | HIF1A (0.63) | CYP3A4MAPK1KDM4ETDP1MAPT | |
| SCHEMBL8772350 | 0.69 | CA2 (0.52) | CYP3A4KDM4ETDP1MAPTALDH1A1 | |
| SCHEMBL7109825 | 0.69 | MAPT (0.57) | CYP3A4MAPK1KDM4ETDP1MAPT | |
| SCHEMBL8389821 | 0.68 | ALDH1A1 (0.71) | MAPK1KDM4ETDP1MAPTALDH1A1 |
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-2088861-A2 | BENZIMIDAZOLE COMPOUNDS | Takeda Pharmaceutical Company Limited (JP) | 2009-08-19 | — | — | EP | disclosed |
| WO-2008051533-A2 | BENZIMIDAZOLE COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-05-02 | — | — | WO | disclosed |