Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 14/20 | 0.42 |
| ▸ | EDNRB | P24530 | 12/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23536530 | 0.88 | KIT (0.46) | EDNRAEDNRB | |
| SCHEMBL29948618 | 0.85 | KMT2A (0.38) | EDNRAEDNRBHTTNPSR1TSHR | |
| SCHEMBL28867414 | 0.78 | EDNRA (0.45) | EDNRAEDNRBTSHRMEN1CYP2C9 | |
| SCHEMBL29932046 | 0.77 | EDNRA (0.41) | EDNRAEDNRBMEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL29932128 | 0.77 | P2RY1 (0.39) | EDNRAEDNRBHTTTSHRMEN1 | |
| SCHEMBL23536239 | 0.75 | ALDH1A1 (0.35) | HTTTSHRMEN1CYP2C9CYP2C19 | |
| SCHEMBL23536514 | 0.73 | BRD4 (0.40) | HTTNPSR1TSHRTP53MEN1 | |
| SCHEMBL29071633 | 0.67 | ALDH1A1 (0.46) | HTTTSHRTP53MEN1CYP2C19 | |
| SCHEMBL18129575 | 0.65 | IGF1R (0.48) | — | |
| SCHEMBL23536235 | 0.64 | HTR6 (0.46) | — |
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-2021127337-A1 | TRPML MODULATORS | CASMA THERAPEUTICS, INC. (US) | 2021-06-24 | — | — | WO | disclosed |