Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20085098 | 0.92 | — | — | |
| SCHEMBL20084487 | 0.91 | RAB9A (0.40) | NPC1RAB9A | |
| SCHEMBL20085013 | 0.89 | NPC1 (0.31) | NPC1RAB9A | |
| SCHEMBL20085051 | 0.88 | — | — | |
| SCHEMBL20084682 | 0.87 | HDAC1 (0.31) | HDAC1HDAC6CA1CA2CA9 | |
| SCHEMBL21572600 | 0.80 | HDAC1 (0.31) | HDAC1HDAC6CA1CA2CA9 | |
| SCHEMBL20085114 | 0.80 | RAB9A (0.39) | NPC1RAB9AKDM4E | |
| SCHEMBL20084333 | 0.79 | RAB9A (0.39) | NPC1RAB9A | |
| SCHEMBL21572143 | 0.77 | RAB9A (0.37) | NPC1RAB9A | |
| SCHEMBL20084989 | 0.77 | HDAC1 (0.32) | HDAC1HDAC6CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3312172-A1 | AMINOPYRAZOLE DERIVATIVES | Chugai Seiyaku Kabushiki Kaisha (JP) | 2018-04-25 | — | — | EP | disclosed |