Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TNF | P01375 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28157313 | 0.93 | RXFP1 (0.46) | HDAC4HDAC6MAPTTP53RXFP1 | |
| SCHEMBL28156807 | 0.91 | MEN1 (0.53) | HDAC4HDAC6MAPTTP53RXFP1 | |
| SCHEMBL28156782 | 0.85 | LMNA (0.42) | MAPTTP53RXFP1LMNAPOLB | |
| SCHEMBL28156810 | 0.84 | MAPT (0.42) | MAPTTP53RXFP1LMNAPOLB | |
| SCHEMBL28157366 | 0.83 | MAPT (0.41) | HDAC4HDAC6MAPTTP53LMNA | |
| SCHEMBL28846370 | 0.82 | GSTO1 (0.42) | MAPTTP53LMNAPOLBCASP3 | |
| SCHEMBL28157364 | 0.82 | LMNA (0.45) | MAPTTP53RXFP1LMNAPOLB | |
| SCHEMBL16246408 | 0.81 | CFTR (0.68) | HDAC4HDAC6MAPTTP53RXFP1 | |
| SCHEMBL28157321 | 0.79 | TP53 (0.44) | MAPTTP53RXFP1LMNAPOLB | |
| SCHEMBL28157305 | 0.79 | MEN1 (0.48) | MAPTTP53RXFP1LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-105531268-B | Noval chemical compound and its pharmaceutical composition for treating cystic fibrosis | 加拉佩格斯股份有限公司 | 2017-09-12 | — | — | CN | disclosed |