Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 6/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.31 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.30 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.30 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4974751 | 0.98 | OPRD1 (0.38) | OPRD1SIGMAR1CHRM5CHRM3MEN1 | |
| SCHEMBL4557392 | 0.81 | OPRD1 (0.42) | OPRD1SIGMAR1CHRM5CHRM3MEN1 | |
| SCHEMBL4558787 | 0.79 | POLB (0.51) | OPRD1MEN1KMT2A | |
| SCHEMBL11064005 | 0.76 | SIGMAR1 (0.51) | OPRD1SIGMAR1CHRM5CHRM3MEN1 | |
| SCHEMBL5504463 | 0.73 | SIGMAR1 (0.39) | OPRD1SIGMAR1CHRM5CHRM3CA12 | |
| SCHEMBL21815527 | 0.70 | OPRD1 (0.39) | OPRD1OPRM1 | |
| SCHEMBL29952348 | 0.70 | OPRD1 (0.35) | OPRD1SIGMAR1CHRM5CHRM3MEN1 | |
| SCHEMBL1417902 | 0.69 | OPRD1 (0.42) | OPRD1SIGMAR1CHRM5CHRM3MEN1 | |
| SCHEMBL3624302 | 0.69 | OPRD1 (0.52) | OPRD1SIGMAR1MEN1KMT2AOPRM1 | |
| SCHEMBL6603037 | 0.68 | SIGMAR1 (0.44) | OPRD1SIGMAR1CHRM5CHRM3MEN1 |
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 4 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 |
| EP-1753727-A1 | NOVEL CIS-IMIDAZOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 2007-02-21 | — | — | 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 |
| WO-2005110996-A1 | NOVEL CIS-IMIDAZOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 2005-11-24 | — | — | WO | disclosed |