Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 6/20 | 0.49 |
| ▸ | HTT | P42858 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL931826 | 0.85 | MAPT (0.53) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL12553675 | 0.78 | MAPT (0.53) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL2011280 | 0.78 | HTT (0.65) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL31335625 | 0.78 | MAPT (0.53) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL31335908 | 0.77 | HSP90AA1 (0.53) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL28261822 | 0.76 | HSP90AA1 (0.50) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL4567034 | 0.76 | MAPT (0.51) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL8895485 | 0.76 | MAPT (0.60) | LMNAHTTMAPTHSD17B10KDM4E | |
| SCHEMBL12658712 | 0.74 | HSP90AA1 (0.57) | HSD17B10HSP90AA1HSP90AB1HPGDSMN1; SMN2 | |
| SCHEMBL30474394 | 0.74 | HSP90AA1 (0.57) | HSD17B10HSP90AA1HSP90AB1HPGDSMN1; SMN2 |
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-2021137665-A1 | 1, 2, 3-TRIAZOLE DERIVATIVE COMPOUND AS HSP90 INHIBITOR, AND USE THEREOF | 이화여자대학교 산학협력단 | 2021-07-08 | — | — | WO | disclosed |