Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL11875487 | 0.78 | ADORA3 (0.56) | ADORA3ADORA1ADORA2ARXFP1MAPT | |
| SCHEMBL4586177 | 0.75 | NPM1 (0.37) | ADORA3ADORA1ADORA2AMAPTHTT | |
| SCHEMBL4585307 | 0.71 | ADORA3 (0.35) | ADORA3ADORA1ADORA2AMAPTHTT | |
| SCHEMBL11868424 | 0.71 | PKM (0.41) | ADORA3ADORA1ADORA2ACYP1A2PDE2A | |
| SCHEMBL11864169 | 0.71 | ALDH1A1 (0.40) | ADORA3ADORA1ADORA2AMAPTHTT | |
| SCHEMBL11868175 | 0.69 | GAA (0.45) | ADORA3ADORA1ADORA2ARXFP1MAPT | |
| SCHEMBL29305737 | 0.68 | DYRK1A (0.46) | MAPTHTTKDM4EALDH1A1RAB9A | |
| SCHEMBL8828592 | 0.68 | SLC9A1 (0.47) | MAPTKDM4EALDH1A1RAB9ACNR1 | |
| SCHEMBL11868525 | 0.66 | CHEK1 (0.58) | ADORA3ADORA1RXFP1MAPTHTT | |
| SCHEMBL13862926 | 0.62 | HPGD (0.49) | MAPTHTTKDM4EALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-3987196-A | FUNGISTATS | ELI LILLY AND COMPANY (US) | 1976-10-19 | — | — | US | disclosed |