Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BIRC2 | Q13490 | 10/20 | 0.53 |
| ▸ | XIAP | P98170 | 7/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11207344 | 0.86 | BIRC2 (0.53) | BIRC2XIAPGRIN2DGRIN3BTHRB | |
| SCHEMBL16509233 | 0.81 | BIRC2 (0.65) | BIRC2XIAP | |
| SCHEMBL13993896 | 0.79 | SIGMAR1 (0.38) | BIRC2CYP1A2ALOX15CYP2C19PAOX | |
| SCHEMBL28233194 | 0.79 | BIRC2 (0.50) | BIRC2XIAPGRIN2DGRIN3BTHRB | |
| SCHEMBL28233170 | 0.79 | BIRC2 (0.50) | BIRC2XIAPGRIN2DGRIN3BTHRB | |
| SCHEMBL28234131 | 0.79 | BIRC2 (0.50) | BIRC2XIAPGRIN2DGRIN3BTHRB | |
| SCHEMBL19107795 | 0.79 | BIRC2 (0.47) | BIRC2XIAPLMNA | |
| SCHEMBL18723951 | 0.79 | BIRC2 (0.47) | BIRC2XIAPLMNA | |
| SCHEMBL18723959 | 0.79 | BIRC2 (0.47) | BIRC2XIAPLMNA | |
| SCHEMBL14530951 | 0.78 | BIRC2 (0.49) | BIRC2XIAPGRIN2DGRIN3BTHRB |
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 |