Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGG1 | O15527 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.41 |
| ▸ | FNTB | P49356 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23716111 | 0.93 | OGG1 (0.45) | OGG1SLC6A4FNTAFNTBTRPM8 | |
| SCHEMBL23716193 | 0.92 | OGG1 (0.44) | OGG1ALDH1A1WDR5 | |
| SCHEMBL23715793 | 0.84 | SYK (0.45) | FNTAFNTBCYP1A2ALDH1A1MAPT | |
| SCHEMBL23715829 | 0.81 | S1PR3 (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23716135 | 0.81 | KMT2A (0.37) | CYP1A2ALDH1A1MAPTGAA | |
| SCHEMBL23715936 | 0.77 | NPC1 (0.44) | SLC6A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL23715832 | 0.77 | S1PR3 (0.58) | — | |
| SCHEMBL23716330 | 0.76 | MDM2 (0.38) | SLC6A4ALDH1A1 | |
| SCHEMBL23715777 | 0.74 | GPR88 (0.42) | MAPK1CYP2C9 | |
| SCHEMBL9627765 | 0.73 | OGG1 (0.51) | OGG1ALDH1A1MAPTWDR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3209732-B1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | SCRIPPS RESEARCH INST (US) | 2021-08-04 | — | — | EP | disclosed |