Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL27892799 | 0.85 | KMT2A (0.49) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL55659 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL15485147 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL4959102 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL4960570 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL4556222 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL3356780 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL4959489 | 0.82 | KMT2A (0.55) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| Methane SCHEMBL2213416 | 0.80 | KMT2A (0.53) | NUDT1BACE1MEN1KMT2APTGDR2 | |
| SCHEMBL9181335 | 0.80 | KMT2A (0.53) | NUDT1BACE1MEN1KMT2APTGDR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4174460-A | Process for the hydroxylation of phenols and phenol ethers in the nucleus | BAYER AKTIENGESELLSCHAFT (DE) | 1979-11-13 | — | — | US | disclosed |