Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.49 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 5/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | P4HB | P07237 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10025260 | 0.97 | CYP2A6 (0.54) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL11983156 | 0.97 | CYP2A6 (0.54) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| Benzene SCHEMBL28562972 | 0.93 | CYP2A6 (0.58) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL550265 | 0.92 | CYP2A6 (0.52) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30785347 | 0.91 | CYP2A6 (0.60) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL12360063 | 0.91 | CYP2A6 (0.60) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL550148 | 0.91 | CYP2A6 (0.60) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL19888269 | 0.86 | CYP2A6 (0.58) | CYP19A1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL368887 | 0.84 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP3A4TP53MAPT | |
| SCHEMBL12068186 | 0.84 | CYP2A6 (0.71) | 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 |
|---|---|---|---|---|---|---|---|
| US-8163402-B2 | Polymer comprising phenyl pyridine units | GENERAL ELECTRIC COMPANY (US) | 2012-04-24 | — | — | US | disclosed |