Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 6/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.34 |
| ▸ | F9 | P00740 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 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 | |
|---|---|---|---|---|
| SCHEMBL23196839 | 0.94 | MEN1 (0.34) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197431 | 0.93 | CYP3A4 (0.36) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197547 | 0.92 | CYP3A4 (0.35) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197446 | 0.91 | DHODH (0.38) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197228 | 0.90 | F9 (0.34) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197774 | 0.90 | ALOX5 (0.44) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197436 | 0.89 | ENPP1 (0.34) | CYP3A4CYP2C8CYP2C9DHODHALDH1A1 | |
| SCHEMBL23196838 | 0.89 | MEN1 (0.34) | ALOX5CYP3A4CYP2C8CYP2C9DHODH | |
| SCHEMBL23197029 | 0.88 | ATM (0.39) | CYP3A4CYP2C8CYP2C9DHODHALDH1A1 | |
| SCHEMBL23197776 | 0.88 | LIMK1 (0.33) | ALOX5CYP3A4CYP2C8CYP2C9DHODH |
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-2021066397-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2021-04-08 | — | — | WO | disclosed |