Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 6/20 | 0.54 |
| ▸ | GAA | P10253 | 9/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | GFER | P55789 | 4/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | THRB | P10828 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PLEC | Q15149 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16634599 | 0.80 | HCAR3 (0.53) | MAP2K1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL16634598 | 0.80 | HCAR3 (0.53) | MAP2K1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL16634655 | 0.79 | GAA (0.59) | GAAKDM4EGFERHSD17B10MEN1 | |
| SCHEMBL23999961 | 0.77 | GAK (0.47) | MAP2K1 | |
| SCHEMBL31311113 | 0.77 | KMT2A (0.49) | MAP2K1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL27401241 | 0.72 | KDM4E (0.60) | MAP2K1GAAKDM4EMEN1KMT2A | |
| SCHEMBL7387168 | 0.71 | KDM4E (0.51) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL20442608 | 0.71 | KDM4E (0.49) | MAP2K1GAAKDM4EGFERHSD17B10 | |
| SCHEMBL3665143 | 0.71 | KDM4E (0.59) | GAAKDM4EGFERHSD17B10MEN1 | |
| SCHEMBL9535914 | 0.71 | MAP2K1 (0.47) | MAP2K1GAAKDM4EALDH1A1SMN1; SMN2 |
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 |