Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16634742 | 1.00 | ALDH1A1 (0.54) | ALDH1A1HTTRAB9AHCAR3MAPT | |
| SCHEMBL18754336 | 0.84 | ALDH1A1 (0.58) | ALDH1A1HTTRAB9AMAPTKMT2A | |
| SCHEMBL16657375 | 0.83 | ALDH1A1 (0.70) | ALDH1A1HTTRAB9AMAPTKMT2A | |
| SCHEMBL16634858 | 0.82 | HCAR3 (0.63) | ALDH1A1HCAR3MAPTKMT2AMEN1 | |
| SCHEMBL16634860 | 0.82 | HCAR3 (0.63) | ALDH1A1HCAR3MAPTKMT2AMEN1 | |
| SCHEMBL4379830 | 0.81 | ALDH1A1 (0.58) | ALDH1A1HTTRAB9AMAPTKMT2A | |
| SCHEMBL16657400 | 0.78 | HTT (0.67) | ALDH1A1HTTRAB9AMAPTKMT2A | |
| SCHEMBL16634569 | 0.78 | KMT2A (0.57) | ALDH1A1HCAR3MAPTKMT2AMEN1 | |
| SCHEMBL16634593 | 0.78 | HCAR3 (0.57) | ALDH1A1HCAR3MAPTKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL9335968 | 0.78 | ALDH1A1 (0.67) | ALDH1A1HTTRAB9AHCAR3MAPT |
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 |