Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.65 |
| ▸ | MEN1 | O00255 | 4/20 | 0.65 |
| ▸ | GRM5 | P41594 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | CCR3 | P51677 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HTR7 | P34969 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13847098 | 1.00 | KMT2A (0.65) | KMT2AMEN1GRM5CYP2D6CYP2C9 | |
| SCHEMBL1116603 | 0.87 | GRM5 (0.77) | KMT2AMEN1GRM5CCR3L3MBTL1 | |
| SCHEMBL20147585 | 0.85 | KMT2A (0.61) | KMT2AMEN1GRM5CCR3L3MBTL1 | |
| SCHEMBL21651961 | 0.85 | CCR3 (0.67) | KMT2AMEN1GRM5CCR3L3MBTL1 | |
| SCHEMBL13959947 | 0.84 | NPC1 (0.72) | KMT2AMEN1CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL18579817 | 0.84 | KMT2A (0.50) | KMT2AMEN1CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL3649906 | 0.83 | ATR (0.53) | KMT2AMEN1CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL31495180 | 0.83 | KMT2A (0.66) | KMT2AMEN1CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL3649905 | 0.83 | SMYD3 (0.56) | KMT2AMEN1CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL13294374 | 0.82 | GRM5 (0.81) | KMT2AMEN1GRM5L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110835336-B | Oxygen-containing heterocyclic substituted azole compound and application thereof | 中国药科大学 | 2022-10-04 | — | — | CN | disclosed |