Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14579483 | 0.87 | CYP3A4 (0.43) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14579486 | 0.81 | TSHR (0.44) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14579487 | 0.80 | CYP3A4 (0.55) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13178024 | 0.80 | MAPT (0.53) | TSHRCYP1A2MAPTLMNAMEN1 | |
| SCHEMBL8050704 | 0.74 | L3MBTL1 (0.58) | TSHRALDH1A1MAPTLMNAGAA | |
| SCHEMBL16212066 | 0.73 | CYP3A4 (0.52) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL15603995 | 0.71 | CYP3A4 (0.57) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14998304 | 0.71 | TDP1 (0.52) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29384907 | 0.71 | MAPT (0.67) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL30513726 | 0.71 | MAPT (0.67) | TSHRCYP1A2CYP3A4CYP2D6CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7179308-B2 | Ethylenically-unsaturated blue anthraquinone dyes | EASTMAN CHEMICAL COMPANY (US) | 2007-02-20 | — | — | US | disclosed |
| US-7172634-B2 | Ethylenically-unsaturated blue anthraquinone dyes | EASTMAN CHEMICAL COMPANY (US) | 2007-02-06 | — | — | US | disclosed |
| US-7172634-B2 | Ethylenically-unsaturated blue anthraquinone dyes | EASTMAN CHEMICAL COMPANY (US) | 2007-02-06 | — | — | US | disclosed |