Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18833893 | 0.90 | ALDH1A1 (0.43) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL19374882 | 0.90 | MEN1 (0.44) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL19375320 | 0.87 | ALDH1A1 (0.39) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL18834990 | 0.83 | ALDH1A1 (0.48) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL18835186 | 0.82 | ALDH1A1 (0.38) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL18834573 | 0.81 | TRPC5 (0.51) | ALDH1A1MAPTTP53ADRA2A | |
| SCHEMBL18835068 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL18833721 | 0.72 | MEN1 (0.41) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL15922546 | 0.68 | KMT2A (0.56) | ALDH1A1MAPTMEN1KMT2ANPSR1 | |
| SCHEMBL18833778 | 0.67 | ALDH1A1 (0.43) | ALDH1A1MAPTMEN1KMT2ANPSR1 |
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-2970303-B1 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES INC (US) | 2017-05-10 | — | — | EP | disclosed |