Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL11194057 | 0.81 | LMNA (0.48) | TSHRALDH1A1TDP1L3MBTL1CYP2C19 | |
| SCHEMBL10692223 | 0.79 | TSHR (0.56) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| Aniline SCHEMBL28107375 | 0.78 | TSHR (0.55) | TSHRALDH1A1CYP3A4TDP1L3MBTL1 | |
| Aniline SCHEMBL10692732 | 0.78 | TSHR (0.55) | TSHRALDH1A1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL3725404 | 0.78 | ALDH1A1 (0.42) | TSHRALDH1A1L3MBTL1MAPK1MEN1 | |
| SCHEMBL7757804 | 0.78 | ALDH1A1 (0.34) | TSHRALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL10691258 | 0.77 | TSHR (0.39) | TSHRALDH1A1CYP3A4L3MBTL1KDM4E | |
| SCHEMBL968495 | 0.75 | LMNA (0.48) | TSHRALDH1A1KDM4EMAPK1AOC3 | |
| Aniline SCHEMBL27375431 | 0.75 | TSHR (0.58) | TSHRALDH1A1CYP3A4TDP1L3MBTL1 | |
| SCHEMBL10694382 | 0.75 | TSHR (0.37) | TSHRL3MBTL1CYP1A2CYP2D6CYP2C19 |
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-4754024-A | Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups | CIBA-GEIGY CORPORATION | 1988-06-28 | — | — | US | disclosed |