Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28924859 | 0.90 | MEN1 (0.55) | MEN1KMT2AATMCYP1A2NPC1 | |
| SCHEMBL28652951 | 0.86 | KMT2A (0.47) | MEN1KMT2AATMCYP1B1CYP1A2 | |
| SCHEMBL28641606 | 0.86 | MEN1 (0.49) | MEN1KMT2AATMNPC1RAB9A | |
| SCHEMBL28470784 | 0.86 | ADORA2A (0.56) | MEN1KMT2AATMNPC1RAB9A | |
| SCHEMBL16436772 | 0.84 | MEN1 (0.60) | MEN1KMT2AATMCYP1B1CYP1A2 | |
| SCHEMBL18455708 | 0.83 | MEN1 (0.68) | MEN1KMT2AATMCYP1B1CYP1A2 | |
| SCHEMBL28637623 | 0.82 | MEN1 (0.46) | MEN1KMT2AATMCYP1A2NPC1 | |
| SCHEMBL16211433 | 0.82 | MEN1 (0.71) | MEN1KMT2AATMCYP1B1CYP1A2 | |
| SCHEMBL29674917 | 0.82 | MEN1 (0.71) | MEN1KMT2AATMCYP1B1CYP1A2 | |
| SCHEMBL9889191 | 0.82 | MEN1 (0.71) | MEN1KMT2AATMCYP1B1CYP1A2 |
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-110606839-B | Green synthesis method of polysubstituted quinazoline derivative | 南方医科大学 | 2021-10-08 | — | — | CN | claimed |