Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 2/20 | 0.37 |
| ▸ | ERN1 | O75460 | 3/20 | 0.34 |
| ▸ | DHODH | Q02127 | 3/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8905392 | 0.90 | NQO1 (0.36) | NQO1ERN1P2RX3ARMEN1 | |
| SCHEMBL8906218 | 0.86 | CETP (0.44) | ERN1CETPAR | |
| SCHEMBL8732768 | 0.84 | AR (0.40) | NQO1DHODHAR | |
| SCHEMBL8736522 | 0.83 | THRA (0.40) | P2RX3ALDH1A1KMT2ASLC22A12TDP1 | |
| SCHEMBL8904879 | 0.82 | AR (0.37) | NQO1ERN1P2RX3ARMEN1 | |
| SCHEMBL8904217 | 0.80 | MEN1 (0.36) | NQO1ERN1CETPMEN1ALDH1A1 | |
| SCHEMBL8906210 | 0.78 | CETP (0.41) | ERN1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8904950 | 0.77 | ERN1 (0.38) | NQO1ERN1MEN1ALDH1A1KMT2A | |
| SCHEMBL8905228 | 0.76 | ERN1 (0.39) | NQO1ERN1CYP1A2MEN1ALDH1A1 | |
| SCHEMBL8733885 | 0.76 | KMT2A (0.39) | P2RX3ARKMT2ASLC22A12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5677342-A | ANTIDIABETIC AGENT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-10-14 | — | — | US | claimed |
| US-5677342-A | ANTIDIABETIC AGENT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-10-14 | — | — | US | disclosed |