Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 3/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL23514971 | 0.91 | EDNRA (0.39) | ALDH1A1MAPK1SRD5A2MAPTSMN1; SMN2 | |
| SCHEMBL23514947 | 0.87 | ALDH1A1 (0.35) | ALDH1A1MAPK1SRD5A2MAPTSMN1; SMN2 | |
| SCHEMBL23515230 | 0.83 | EDNRA (0.43) | ALDH1A1MAPK1MAPTSMN1; SMN2HTT | |
| SCHEMBL25012556 | 0.77 | EDNRA (0.52) | — | |
| SCHEMBL23514968 | 0.76 | EDNRA (0.36) | ALDH1A1MAPTSMN1; SMN2HTTKDM4E | |
| SCHEMBL23515284 | 0.75 | EDNRB (0.32) | — | |
| SCHEMBL23515205 | 0.71 | EDNRA (0.44) | ALDH1A1MAPK1MAPTSMN1; SMN2HTT | |
| SCHEMBL25012561 | 0.66 | EDNRA (0.40) | — | |
| SCHEMBL23515193 | 0.64 | EDNRB (0.47) | ALDH1A1MAPK1SRD5A2MAPTSMN1; SMN2 | |
| Piperonylic Acid SCHEMBL142318 | 0.60 | ALDH1A1 (1.00) | ALDH1A1MAPK1SRD5A2MAPTSMN1; SMN2 |
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 |