Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.49 |
| ▸ | GAPDH | P04406 | 2/20 | 0.49 |
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18084829 | 0.92 | GAPDH (0.49) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL16712928 | 0.90 | HSP90AA1 (0.49) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL6934114 | 0.89 | HSP90AA1 (0.58) | SYKHSP90AA1HSP90AB1HTTALDH1A1 | |
| SCHEMBL18087562 | 0.83 | MAOB (0.53) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL28960702 | 0.82 | BACE1 (0.67) | SYKGAPDHBACE1HTTALDH1A1 | |
| SCHEMBL16712944 | 0.82 | AKR1C3 (0.50) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL16713007 | 0.81 | SYK (0.53) | SYKHSP90AA1HSP90AB1HTTTP53 | |
| SCHEMBL24313994 | 0.81 | HTT (0.56) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL18084823 | 0.80 | GAPDH (0.49) | SYKHSP90AA1HSP90AB1GAPDHBACE1 | |
| SCHEMBL15225947 | 0.78 | HSP90AA1 (0.58) | SYKHSP90AA1HSP90AB1HTTALDH1A1 |
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-3066072-B1 | BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS | UNIV KANSAS (US) | 2021-11-03 | — | — | EP | disclosed |
| WO-2015070091-A1 | BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS | THE UNIVERSITY OF KANSAS (US) | 2015-05-14 | — | — | WO | disclosed |