Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27171684 | 0.80 | PTPN22 (0.52) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL12213109 | 0.78 | CA1 (0.47) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL29169707 | 0.77 | ALDH1A1 (0.48) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL347056 | 0.77 | CYP1A2 (0.44) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL30785066 | 0.77 | CYP1A2 (0.44) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL24776367 | 0.76 | ALDH1A1 (0.52) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL9780249 | 0.75 | ALDH1A1 (0.47) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| Ammonia Solution, Strong SCHEMBL21314237 | 0.75 | CYP1A2 (0.43) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL1583765 | 0.75 | CYP1A2 (0.43) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 | |
| SCHEMBL28136648 | 0.75 | CYP1A2 (0.43) | HSD17B10CYP2A6ALDH1A1TSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0405389-B1 | Process for producing an aromatic compound | MITSUBISHI CHEM IND (JP) | 1995-01-04 | — | — | EP | disclosed |
| US-5159082-A | Catalytic coupling of an aromatic sulfinic acid with an aromatic halogen compound | MITSUBISHI KASEI CORPORATION (JP) | 1992-10-27 | — | — | US | disclosed |
| EP-0405389-A1 | Process for producing an aromatic compound | Mitsubishi Chemical Corporation (JP) | 1991-01-02 | — | — | EP | disclosed |