Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.47 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.44 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18704147 | 1.00 | FFAR1 (0.47) | FFAR1GABBR2GABBR1CYP2C9KMT2A | |
| SCHEMBL18704217 | 0.89 | FFAR1 (0.36) | FFAR1GABBR2GABBR1CYP2C9KMT2A | |
| SCHEMBL18704218 | 0.89 | FFAR1 (0.36) | FFAR1GABBR2GABBR1CYP2C9KMT2A | |
| SCHEMBL28608240 | 0.83 | FFAR1 (0.51) | FFAR1FNTAFNTB | |
| SCHEMBL20945587 | 0.82 | FFAR1 (0.39) | FFAR1 | |
| SCHEMBL20945590 | 0.82 | FFAR1 (0.39) | FFAR1 | |
| SCHEMBL20661145 | 0.82 | UTS2R (0.38) | FFAR1KMT2AMEN1THRBCYP26A1 | |
| SCHEMBL20660957 | 0.81 | AOC3 (0.40) | KMT2ALMNACYP2D6CYP2C19MEN1 | |
| SCHEMBL18704170 | 0.78 | SMN1; SMN2 (0.36) | KMT2ALMNAMEN1 | |
| SCHEMBL18704169 | 0.78 | SMN1; SMN2 (0.36) | KMT2ALMNAMEN1 |
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-2017060488-A1 | NEW TRPA1 ANTAGONISTS | ALMIRALL, S.A. (ES) | 2017-04-13 | — | — | WO | disclosed |