Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL8625262 | 0.88 | CYP3A4 (0.52) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL11686280 | 0.88 | CYP3A4 (0.52) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL9654927 | 0.85 | CYP3A4 (0.51) | KMT2AALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7644622 | 0.84 | CYP3A4 (0.60) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL9292208 | 0.78 | CYP3A4 (0.51) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL10878812 | 0.77 | DHODH (0.54) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL8991598 | 0.77 | CA1 (0.53) | KMT2AALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8029721 | 0.77 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP2C9SMN1; SMN2 | |
| SCHEMBL11746525 | 0.76 | CYP3A4 (0.46) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL11746515 | 0.76 | CYP3A4 (0.46) | KMT2AMEN1ALDH1A1CYP3A4CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4005032-A | Liquid crystalline composition having mixed cholesteric-nematic properties | XEROX CORPORATION (US) | 1977-01-25 | — | — | US | claimed |
| US-4156558-A | Incoherent to coherent transducer and method of manufacture | GRUMMAN AEROSPACE CORPORATION (US) | 1979-05-29 | — | — | US | disclosed |