Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.56 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.56 |
| ▸ | MYC | P01106 | 1/20 | 0.56 |
| ▸ | MAX | P61244 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CASP6 | P55212 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | FBP1 | P09467 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.47 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16634661 | 1.00 | HCAR3 (0.57) | HCAR3AKR1C3AKR1C2MYCMAX | |
| SCHEMBL30378593 | 0.87 | ALDH1A1 (0.59) | TDP1KMT2AMEN1MAPTGAA | |
| SCHEMBL2508268 | 0.87 | ALDH1A1 (0.59) | TDP1KMT2AMEN1MAPTGAA | |
| SCHEMBL5496871 | 0.84 | TDP1 (0.65) | HCAR3AKR1C3AKR1C2MYCTDP1 | |
| SCHEMBL20897509 | 0.83 | HCAR3 (0.77) | HCAR3AKR1C3AKR1C2KMT2AMEN1 | |
| SCHEMBL31237080 | 0.83 | KMT2A (0.57) | HCAR3AKR1C3AKR1C2MYCMAX | |
| SCHEMBL28738890 | 0.81 | EPAS1 (0.55) | TDP1KMT2AMEN1MAPTGAA | |
| SCHEMBL9537323 | 0.81 | CASP6 (0.51) | HCAR3TDP1KMT2AMEN1MAPT | |
| SCHEMBL25353287 | 0.80 | AKR1C3 (0.53) | AKR1C3AKR1C2KMT2AMEN1MAPT | |
| SCHEMBL29703105 | 0.80 | AKR1C3 (0.53) | AKR1C3AKR1C2KMT2AMEN1MAPT |
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-2015052675-A1 | SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2015-04-16 | — | — | WO | disclosed |