Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29870911 | 0.77 | CYP3A4 (0.53) | CD44CYP3A4TSHRPIK3CAMAPT | |
| SCHEMBL2934547 | 0.77 | CYP3A4 (0.53) | CD44CYP3A4TSHRPIK3CAMAPT | |
| SCHEMBL20260288 | 0.73 | ACHE (0.33) | CYP3A4TSHRPIK3CATDP1 | |
| SCHEMBL29366969 | 0.72 | POLB (0.48) | CD44CYP3A4TSHRPIK3CAMAPT | |
| SCHEMBL34364 | 0.72 | POLB (0.48) | CD44CYP3A4TSHRPIK3CAMAPT | |
| SCHEMBL9285276 | 0.72 | POLB (0.62) | CD44CYP3A4TSHRPIK3CAMEN1 | |
| SCHEMBL29087953 | 0.72 | POLB (0.42) | CD44CYP3A4TSHRPIK3CALMNA | |
| SCHEMBL29087964 | 0.72 | CD44 (0.42) | CD44CYP3A4TSHRPIK3CAMAPT | |
| Hydrochloric Acid SCHEMBL10761313 | 0.70 | POLB (0.46) | CD44CYP3A4TSHRPIK3CALMNA | |
| Methane SCHEMBL701905 | 0.70 | POLB (0.46) | CD44CYP3A4TSHRPIK3CALMNA |
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-2018104766-A1 | 3-(2,3-DIHYDRO-1H-INDEN-5-YL)PROPANOIC ACID DERIVATIVES AND THEIR USE AS NRF2 REGULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-06-14 | — | — | WO | disclosed |