Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL3997482 | 0.87 | MAPT (0.47) | TSHRMAPTHSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL11452642 | 0.77 | TSHR (0.50) | TSHRMAPTHSD17B10MCL1CYP3A4 | |
| SCHEMBL4004644 | 0.74 | TSHR (0.47) | TSHRMAPTHSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL2828736 | 0.74 | TSHR (0.75) | TSHRHSD17B10CYP3A4ALDH1A1KMT2A | |
| SCHEMBL7797982 | 0.71 | TSHR (0.50) | TSHRHSD17B10CYP3A4ALDH1A1KMT2A | |
| SCHEMBL22515407 | 0.71 | CISD1 (0.39) | TSHRMAPTHSD17B10ALDH1A1KMT2A | |
| SCHEMBL29384448 | 0.71 | CISD1 (0.39) | TSHRMAPTHSD17B10ALDH1A1KMT2A | |
| SCHEMBL4006354 | 0.71 | TSHR (0.50) | TSHRMAPTCYP3A4ALDH1A1KMT2A | |
| SCHEMBL4001970 | 0.71 | TSHR (0.47) | TSHRMAPTHSD17B10CYP3A4ALDH1A1 | |
| SCHEMBL4001527 | 0.71 | TSHR (0.56) | TSHRMAPTALDH1A1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1861376-A1 | CIS-2,4,5-TRIARYL-IMIDAZOLINES AND THEIR USE AS ANTI-CANCER MEDICAMENTS | F. Hoffmann-Roche AG (CH) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006097261-A1 | CIS-2,4,5-TRIARYL-IMIDAZOLINES AND THEIR USE AS ANTI-CANCER MEDICAMENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-09-21 | — | — | WO | disclosed |