Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Pyrene SCHEMBL2125072 | 0.90 | TSHR (0.65) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL545861 | 0.86 | MAOA (0.68) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL29355380 | 0.86 | MAOA (0.68) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL31388525 | 0.86 | MAOA (0.68) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL8180 | 0.86 | MAOA (0.68) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL29478468 | 0.86 | MAOA (0.68) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL28443999 | 0.83 | MAOA (0.59) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| SCHEMBL3766146 | 0.83 | TSHR (0.62) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL1080516 | 0.83 | MAOA (0.65) | TSHRCYP3A4MAOAALDH1A1KDM4E | |
| Fluorene SCHEMBL8378972 | 0.83 | MAOA (0.65) | TSHRCYP3A4MAOAALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105732294-A | Substituted tetraarylbenzene | 默克专利有限公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-102498120-B | Formulation for manufacturing electronic devices | 默克专利有限公司 | 2016-06-08 | — | — | CN | disclosed |