Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 13/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.53 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12258967 | 0.86 | EPHX2 (0.59) | EPHX2EPHX1PIK3CDMAPTCYP1A2 | |
| SCHEMBL26259409 | 0.84 | EPHX2 (0.53) | EPHX2EPHX1KDM1AMAOAMAOB | |
| SCHEMBL20403049 | 0.82 | EPHX2 (0.51) | EPHX2EPHX1KDM1AMAOAMAOB | |
| SCHEMBL21738157 | 0.82 | CHRNB2 (0.42) | EPHX2EPHX1PIK3CDCYP1A2TDP1 | |
| SCHEMBL12850168 | 0.79 | EPHX2 (0.56) | EPHX2EPHX1KDM1AMAOAMAOB | |
| SCHEMBL9891911 | 0.78 | EPHX2 (0.61) | EPHX2EPHX1 | |
| SCHEMBL15722292 | 0.78 | PIK3CD (0.42) | EPHX2EPHX1PIK3CDCYP1A2TDP1 | |
| SCHEMBL21322299 | 0.77 | OPRK1 (0.52) | EPHX2EPHX1PIK3CDMAPT | |
| SCHEMBL2888489 | 0.77 | EPHX2 (0.58) | EPHX2EPHX1KDM1AMAOAMAOB | |
| SCHEMBL3317493 | 0.77 | EPHX2 (0.58) | EPHX2EPHX1KDM1AMAOAMAOB |
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-2021219091-A2 | QUINOXALINONE DERIVATIVE AS IRREVERSIBLE INHIBITOR OF KRAS G12C MUTANT PROTEIN | 北京泰德制药股份有限公司 (CN) | 2021-11-04 | — | — | WO | disclosed |