Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CDC7 | O00311 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.42 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.42 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.42 |
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19933822 | 0.92 | TP53 (0.56) | TP53KMT2AHSP90AA1HSP90B1TRAP1 | |
| SCHEMBL19933881 | 0.91 | TP53 (0.43) | TP53HSP90AA1HSP90B1TRAP1 | |
| SCHEMBL19933819 | 0.87 | TP53 (0.52) | TP53 | |
| SCHEMBL13307632 | 0.85 | MAPT (0.55) | CDC7POLBKMT2APTGS2GAA | |
| SCHEMBL19927471 | 0.84 | PTGS2 (0.56) | CDC7PTGS2MGAMAMY1AGAA | |
| SCHEMBL19933935 | 0.83 | TP53 (0.50) | TP53KMT2A | |
| SCHEMBL19933960 | 0.83 | CDC7 (0.46) | CDC7PTGER4PTGS2MGAMAMY1A | |
| SCHEMBL19933963 | 0.81 | TP53 (0.50) | TP53HSP90AA1HSP90B1TRAP1 | |
| SCHEMBL13307643 | 0.80 | MAPT (0.48) | POLBKMT2APTGS2HSP90AA1HSP90B1 | |
| SCHEMBL19933953 | 0.79 | MAPK14 (0.56) | — |
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-2018045182-A1 | DISUBSTITUTED AND TRISUBTITUTED 1,2,3-TRIAZOLES AS WNT INHIBITORS | THE BOARD OF REGENTS OF HTE UNIVERSITY OF TEXAS SYSTEM (US) | 2018-03-08 | — | — | WO | disclosed |