Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.52 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 5/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11279593 | 0.92 | ALDH1A1 (0.51) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11278157 | 0.90 | ALDH1A1 (0.57) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11285718 | 0.89 | CYP11B1 (0.53) | ALDH1A1CYP3A4TDP1TP53CYP1A2 | |
| SCHEMBL11276740 | 0.88 | CYP11B1 (0.56) | CYP3A4MAPTCYP1A2TBXAS1CYP11B1 | |
| SCHEMBL11279493 | 0.88 | ALDH1A1 (0.51) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11285716 | 0.87 | MAPT (0.57) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11279219 | 0.86 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TDP1TP53CYP1A2 | |
| SCHEMBL10643088 | 0.85 | CYP3A4 (0.63) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11276208 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CYP3A4MAPTTDP1MAPK1 | |
| SCHEMBL11274380 | 0.84 | IDO1 (0.56) | ALDH1A1CYP3A4MAPTTDP1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0064244-A1 | Spermicidal 1-bis(arylalkyl)alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-11-10 | — | — | EP | disclosed |