Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.50 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.45 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16539612 | 0.82 | FFAR1 (0.58) | FFAR1 | |
| SCHEMBL16539817 | 0.81 | FFAR1 (0.55) | FFAR1 | |
| SCHEMBL16552642 | 0.81 | FFAR1 (0.57) | NR4A2ADAM17FFAR1 | |
| SCHEMBL11635080 | 0.80 | NR4A2 (0.45) | NR4A2ADAM17ALDH1A1MAOBALOX5 | |
| SCHEMBL16539100 | 0.80 | FFAR1 (0.44) | NR4A2ALDH1A1MAOBFFAR1KMT2A | |
| SCHEMBL16539217 | 0.79 | SRD5A2 (0.48) | ALDH1A1FFAR1SMN1; SMN2PKMSRD5A2 | |
| SCHEMBL16552576 | 0.79 | FFAR1 (0.55) | ALOX5FFAR1 | |
| SCHEMBL16539571 | 0.79 | FFAR1 (0.43) | NR4A2ALDH1A1MAOBFFAR1SRD5A2 | |
| SCHEMBL15229539 | 0.79 | NR4A2 (0.57) | NR4A2MAOBFFAR1 | |
| SCHEMBL29112417 | 0.79 | TSHR (0.39) | FFAR1KMT2ASMN1; SMN2PKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3031799-B1 | AROMATIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2018-04-04 | — | — | EP | disclosed |
| EP-3031799-A1 | AROMATIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2016-06-15 | — | — | EP | disclosed |