Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GPX4 | P36969 | 1/20 | 0.30 |
| ▸ | JMJD6 | Q6NYC1 | 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 | |
|---|---|---|---|---|
| SCHEMBL13274570 | 0.92 | TP53 (0.36) | TP53KDM5AKDM2BKDM4CKDM5B | |
| SCHEMBL2220897 | 0.88 | KDM5A (0.33) | KDM5AKDM2BKDM4CKDM5BALDH1A1 | |
| SCHEMBL2221099 | 0.85 | TP53 (0.38) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL2221804 | 0.84 | ENPP2 (0.35) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL2223717 | 0.83 | KMT2A (0.33) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL2221341 | 0.83 | PDE10A (0.33) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL2223741 | 0.82 | PDE10A (0.34) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL2219994 | 0.82 | MEN1 (0.37) | ALDH1A1HTTPTGDR2 | |
| SCHEMBL2222006 | 0.82 | GRM2 (0.40) | TP53HTTGRM2 | |
| SCHEMBL2220317 | 0.80 | GRM5 (0.38) | GRM2 |
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-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | disclosed |