Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976789 | 0.90 | GSK3B (0.42) | GSK3BHDAC6CYP1A2MAPK1DYRK1A | |
| SCHEMBL19976846 | 0.89 | KDM4E (0.42) | GSK3BHDAC6MAPK1DYRK1A | |
| SCHEMBL19976961 | 0.89 | GSK3B (0.50) | GSK3BMAP2K4HDAC6HDAC1HDAC2 | |
| SCHEMBL19976767 | 0.89 | GSK3B (0.51) | GSK3BTRPA1MAP2K4HDAC6HDAC1 | |
| SCHEMBL19976866 | 0.86 | DYRK1A (0.42) | GSK3BMAP2K4CYP1A2MAPK1DYRK1A | |
| SCHEMBL19976821 | 0.86 | HDAC6 (0.44) | GSK3BMAP2K4HDAC6HDAC1HDAC2 | |
| SCHEMBL18558419 | 0.85 | LMNA (0.36) | MAP2K4HDAC6MAPK1DYRK1A | |
| SCHEMBL19976764 | 0.85 | GSK3B (0.48) | GSK3BTRPA1MAP2K4HDAC6HDAC1 | |
| SCHEMBL19976729 | 0.85 | HDAC6 (0.49) | GSK3BTRPA1MAP2K4HDAC6HDAC1 | |
| SCHEMBL16752841 | 0.84 | GSK3B (0.46) | GSK3BTRPA1MAP2K4HDAC6MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9920012-B2 | Indazole guanidine F1F0-ATPase inhibitors and therapeutic uses thereof | LYCERA CORPORATION (US) | 2018-03-20 | — | — | US | disclosed |