Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | SREBF2 | Q12772 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10016891 | 0.91 | MAPKAPK2 (0.39) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10016785 | 0.86 | CYP1A2 (0.41) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10017123 | 0.86 | CYP1A2 (0.38) | CYP1A2CYP2A6MAPTLMNANPC1 | |
| SCHEMBL10017013 | 0.85 | TGFBR1 (0.42) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10017104 | 0.84 | CYP1A2 (0.42) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10017121 | 0.83 | CYP1A2 (0.44) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10017222 | 0.83 | CYP1A2 (0.38) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10017079 | 0.83 | CYP11B1 (0.38) | CYP1A2CYP2A6HPGDMAPTLMNA | |
| SCHEMBL10016786 | 0.82 | CYP1A2 (0.43) | CYP1A2CYP2A6MAPTLMNANPC1 | |
| SCHEMBL10017119 | 0.81 | MAPT (0.49) | CYP1A2CYP2A6MAPTCYP3A4 |
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-2012005214-A1 | ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME | JNC株式会社 (JP) | 2012-01-12 | — | — | WO | disclosed |