Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL23309987 | 0.94 | TYR (0.34) | FFAR1FFAR4MEN1TP53CYP3A4 | |
| SCHEMBL20835008 | 0.91 | GABRA1 (0.34) | FFAR1FFAR4TYRGABRA1GABRB2 | |
| SCHEMBL23310000 | 0.86 | GABRA1 (0.35) | FFAR1FFAR4GABRA1GABRB2 | |
| SCHEMBL20834698 | 0.82 | GABRA1 (0.41) | FFAR1FFAR4GABRA1GABRB2 | |
| SCHEMBL20834945 | 0.80 | MEN1 (0.32) | MEN1TP53CYP3A4ALOX5MAPT | |
| SCHEMBL20834901 | 0.79 | MEN1 (0.31) | MEN1TP53CYP3A4ALOX5MAPT | |
| SCHEMBL20835010 | 0.78 | FFAR1 (0.33) | FFAR1FFAR4MEN1TP53CYP3A4 | |
| SCHEMBL23240126 | 0.77 | FFAR1 (0.35) | FFAR1FFAR4ALOX5GABRA1GABRB2 | |
| SCHEMBL28912870 | 0.77 | FFAR1 (0.33) | FFAR1FFAR4TYRGABRA1GABRB2 | |
| SCHEMBL20834947 | 0.77 | TYR (0.32) | TYR |
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-2019052972-A1 | ISOTHIOCYANATO TOLANE DERIVATIVES | MERCK PATENT GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |