Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28018596 | 0.87 | TSHR (0.70) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL29959661 | 0.87 | TSHR (0.70) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL307312 | 0.87 | TSHR (0.70) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL5509791 | 0.84 | TSHR (0.66) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL21073898 | 0.84 | TSHR (0.66) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL8576742 | 0.83 | CTSD (0.59) | TDP1MAPTNPC1RAB9AGAA | |
| SCHEMBL31255865 | 0.83 | CTSD (0.59) | TDP1MAPTNPC1RAB9AGAA | |
| SCHEMBL3481205 | 0.83 | TSHR (0.64) | TSHRL3MBTL1TDP1MAPTNPC1 | |
| SCHEMBL15165310 | 0.82 | GPR35 (0.58) | TSHRL3MBTL1TDP1ALDH1A1KMT2A | |
| SCHEMBL1805930 | 0.81 | TSHR (0.72) | TSHRL3MBTL1TDP1MAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000219656-A | ISOLATION AND PURIFICATION OF 3-NITRO-ORTHO-TOLUIC ACID | SAN CHEM KK | 2000-08-08 | — | — | JP | disclosed |