Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4435101 | 0.90 | BRD4 (0.54) | CYP1A2CYP3A4CYP2C19ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL28258429 | 0.86 | DGKA (0.57) | CYP1A2CYP3A4CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL28252143 | 0.85 | CYP1A2 (0.70) | CYP1A2CYP3A4CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL15707774 | 0.83 | MAPT (0.63) | CYP1A2CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL16673223 | 0.83 | TDP1 (0.57) | L3MBTL1ALDH1A1RAB9ANPSR1LMNA | |
| SCHEMBL19705179 | 0.83 | KDM4E (0.52) | L3MBTL1ALDH1A1LMNATDP1PABPC1 | |
| SCHEMBL21991489 | 0.82 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C19L3MBTL1KMT2A | |
| SCHEMBL11566246 | 0.81 | MAPT (0.54) | CYP1A2CYP3A4CYP2C19BLMPMP22 | |
| SCHEMBL21384542 | 0.81 | CYP1A2 (0.68) | CYP1A2CYP3A4CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL15363151 | 0.81 | PDK2 (0.49) | CYP1A2CYP3A4CYP2C19L3MBTL1PMP22 |
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-2017212425-A1 | CHEMICAL COMPOUNDS AS ATF4 PATHWAY INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-12-14 | — | — | WO | disclosed |