Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL12276365 | 0.82 | ALDH1A1 (0.43) | ALDH1A1PRMT3CARM1PRMT6PRMT1 | |
| SCHEMBL7439150 | 0.82 | SLC6A4 (0.39) | MEN1KMT2AGBA1CYP3A4KDM4E | |
| SCHEMBL28136200 | 0.82 | SKP2 (0.50) | TDP1CYP3A4ALOX15THRBALDH1A1 | |
| SCHEMBL9910784 | 0.79 | ALDH1A1 (0.40) | ALDH1A1POLBMAPTSLC6A4 | |
| SCHEMBL40067 | 0.77 | IDO1 (0.32) | GBA1IDO1SLC6A4 | |
| SCHEMBL2754720 | 0.77 | ALDH1A1 (0.33) | GBA1ALDH1A1KDM4EGAASLC6A4 | |
| SCHEMBL8977699 | 0.77 | CXCR4 (0.34) | GBA1IDO1SLC6A4 | |
| SCHEMBL29398175 | 0.77 | IDO1 (0.32) | GBA1IDO1SLC6A4 | |
| SCHEMBL10620693 | 0.76 | KDM4E (0.39) | TDP1CYP3A4SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL21339722 | 0.76 | SLC6A4 (0.32) | MEN1KMT2AGAAIDO1SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104854098-A | NOVEL BENZIMIDAZOLE DERIVATIVES AS EP4 ANTAGONISTS | Bayer Pharma AG | 2015-08-19 | — | — | CN | disclosed |