Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 4/20 | 0.39 |
| ▸ | EDNRB | P24530 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23514980 | 0.91 | ALDH1A1 (0.36) | ALDH1A1MAPK1MEN1KMT2ANPC1 | |
| SCHEMBL25012556 | 0.86 | EDNRA (0.52) | EDNRAEDNRB | |
| SCHEMBL23514947 | 0.82 | ALDH1A1 (0.35) | EDNRAEDNRBALDH1A1MAPK1NPC1 | |
| SCHEMBL23515230 | 0.79 | EDNRA (0.43) | EDNRAEDNRBALDH1A1MAPK1NPC1 | |
| SCHEMBL25012561 | 0.75 | EDNRA (0.40) | EDNRAEDNRBNPSR1 | |
| SCHEMBL23514968 | 0.73 | EDNRA (0.36) | EDNRAEDNRBALDH1A1MEN1KMT2A | |
| SCHEMBL25013425 | 0.72 | EDNRA (0.70) | EDNRAEDNRB | |
| SCHEMBL23515205 | 0.70 | EDNRA (0.44) | EDNRAEDNRBALDH1A1MAPK1NPC1 | |
| SCHEMBL23515284 | 0.67 | EDNRB (0.32) | EDNRAEDNRB | |
| SCHEMBL23515193 | 0.61 | EDNRB (0.47) | EDNRAEDNRBALDH1A1MAPK1MEN1 |
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-2021118826-A1 | DEUTERIUM-ENRICHED SUBSTITUTED PHENOXYPHENYL ACETIC ACIDS AND ACYLSULFONAMIDES | DHANOA DALJIT (US) | 2021-06-17 | — | — | WO | disclosed |