Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13981778 | 0.82 | HSPA5 (0.44) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL13981807 | 0.80 | ALOX5 (0.33) | — | |
| SCHEMBL14363219 | 0.78 | CYP2C9 (0.46) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL996403 | 0.73 | CA2 (0.63) | CA2CA1HIF1ACYP2C9CYP2C19 | |
| SCHEMBL15450311 | 0.72 | HSPA5 (0.72) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL11517928 | 0.70 | HSPA5 (0.51) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL17500076 | 0.69 | ALDH1A1 (0.48) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL10613533 | 0.68 | HSPA5 (0.61) | HSPA5CA2CA1HIF1ACYP2C9 | |
| SCHEMBL16541267 | 0.68 | ALOX15 (0.38) | SMN1; SMN2ALDH1A1CYP1A2LMNAALOX15 | |
| SCHEMBL28392941 | 0.68 | HSPA5 (0.41) | HSPA5CA2CA1HIF1ACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008148168-A1 | PROCESSES FOR THE PREPARATION OF CALIXARENE DERIVATIVES | THE UNIVERSITY OF WESTERN AUSTRALIA (AU) | 2008-12-11 | — | — | WO | disclosed |