Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.63 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.53 |
| ▸ | METAP2 | P50579 | 1/20 | 0.53 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9920497 | 0.94 | CYP19A1 (0.68) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL21623613 | 0.93 | CYP19A1 (0.71) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24590289 | 0.93 | CYP19A1 (0.71) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL21709035 | 0.92 | CYP19A1 (0.59) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24941653 | 0.91 | CYP19A1 (0.59) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24589928 | 0.91 | CYP19A1 (0.59) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL18270327 | 0.89 | CYP19A1 (0.72) | CYP19A1CYP2A6ALDH1A1MAPTHPGD | |
| SCHEMBL24527291 | 0.89 | CYP19A1 (0.66) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24590034 | 0.89 | CYP19A1 (0.61) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17945297 | 0.89 | CYP19A1 (0.66) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 |
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-2012080052-A1 | BISPYRIMIDINES FOR ELECTRONIC APPLICATIONS | BASF SE (DE) | 2012-06-21 | — | — | WO | disclosed |