Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27688207 | 0.86 | TDO2 (0.38) | TDO2DHFRALOX5MAOBTAAR1 | |
| SCHEMBL4209132 | 0.82 | TAAR1 (0.40) | TAAR1MEN1KMT2AESR2NOTUM | |
| SCHEMBL9648712 | 0.82 | TDO2 (0.40) | TDO2DHFRALOX5MAOBTAAR1 | |
| SCHEMBL28445344 | 0.81 | PTGS2 (0.43) | ADORA2AADORA1 | |
| SCHEMBL7873514 | 0.79 | ESR2 (0.45) | TDO2DHFRALOX5TAAR1GAA | |
| SCHEMBL8616256 | 0.79 | TDO2 (0.38) | TDO2DHFRALOX5MAOBTAAR1 | |
| SCHEMBL1045097 | 0.79 | AKR1C3 (0.44) | MAOBADORA2AADORA1NPC1RAB9A | |
| SCHEMBL16719911 | 0.79 | ALOX5 (0.49) | TDO2DHFRALOX5TAAR1ESR2 | |
| SCHEMBL27707558 | 0.79 | TDO2 (0.40) | TDO2DHFRALOX5MAOBTAAR1 | |
| SCHEMBL435280 | 0.78 | AHR (0.35) | TDO2MAOBNPC1RAB9ANOTUM |
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-0663396-A1 | 2-Arylpyrimidines and herbicidal use thereof | ROHM AND HAAS COMPANY (US) | 1995-07-19 | — | — | EP | claimed |