Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.60 |
| ▸ | RORC | P51449 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5829731 | 0.90 | RORC (0.54) | TSHRRORCCYP2C9CYP2C19CYP1A2 | |
| SCHEMBL2034981 | 0.81 | RORC (0.80) | TSHRRORCCYP2C9CYP2C19CYP1A2 | |
| Benzene SCHEMBL28159019 | 0.81 | CYP2C9 (0.52) | TSHRRORCCYP2C9CYP2C19CYP1A2 | |
| SCHEMBL11699873 | 0.80 | RORC (0.62) | TSHRRORCCYP2C9CYP2C19CYP1A2 | |
| SCHEMBL27578638 | 0.80 | ALDH1A1 (0.69) | TSHRCYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL8986507 | 0.78 | ALDH1A1 (0.61) | TSHRCYP2C9CYP1A2ALDH1A1TDP1 | |
| Benzene SCHEMBL28155736 | 0.78 | ALDH1A1 (0.61) | TSHRCYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL20721726 | 0.78 | TSHR (1.00) | TSHRRORCCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL282162 | 0.78 | TSHR (1.00) | TSHRRORCCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL15485172 | 0.78 | TSHR (1.00) | TSHRRORCCYP1A2CYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4064179-A | CHEMICAL INTERMEDIATES | GENERAL ELECTRIC COMPANY (US) | 1977-12-20 | — | — | US | disclosed |
| US-3952063-A | Process for the preparation of an organomercaptophenol from sulfur, a phenol, and an activated olefin or an epoxy compound | GENERAL ELECTRIC COMPANY (US) | 1976-04-20 | — | — | US | disclosed |