Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MIF | P14174 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Formaldehyde SCHEMBL5622417 | 0.95 | CYP3A4 (0.50) | CYP3A4TSHRMIFMAPK1TDP1 | |
| SCHEMBL5925 | 0.95 | — | — | |
| SCHEMBL245090 | 0.95 | MIF (0.55) | CYP3A4TSHRMIFMAPK1TDP1 | |
| Benzene SCHEMBL11510532 | 0.95 | MIF (0.55) | CYP3A4TSHRMIFMAPK1TDP1 | |
| SCHEMBL19459346 | 0.95 | MIF (0.55) | CYP3A4TSHRMIFMAPK1TDP1 | |
| SCHEMBL1332539 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL10918138 | 0.92 | MIF (0.52) | CYP3A4TSHRMIFMAPK1TDP1 | |
| Hydrochloric Acid SCHEMBL10809249 | 0.92 | MIF (0.52) | CYP3A4TSHRMIFMAPK1TDP1 | |
| Hydrogen Sulfide SCHEMBL2017797 | 0.92 | MIF (0.52) | CYP3A4TSHRMIFMAPK1TDP1 | |
| Water SCHEMBL2017190 | 0.92 | MIF (0.52) | CYP3A4TSHRMIFMAPK1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109790274-A | URETHANE RESIN USING POLYROTAXANE, AND POLISHING PAD | 株式会社德山 | 2019-05-21 | — | — | CN | disclosed |