Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | MAPT | P10636 | 3/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | CES1 | P23141 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.65 |
| ▸ | GSK3B | P49841 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | PLOD2 | O00469 | 2/20 | 0.53 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28972860 | 0.93 | KMT2A (0.57) | KMT2AMEN1MAPTCYP3A4HPGD | |
| SCHEMBL28972862 | 0.93 | KMT2A (0.57) | KMT2AMEN1MAPTCYP3A4HPGD | |
| SCHEMBL11983785 | 0.92 | GSK3B (0.70) | KMT2AMEN1MAPTCYP3A4HPGD | |
| SCHEMBL7981349 | 0.86 | GSK3B (0.63) | KMT2AMEN1MAPTCYP3A4HPGD | |
| SCHEMBL17857765 | 0.86 | GSK3B (0.63) | MAPTGSK3BNPC1RAB9AALDH1A1 | |
| SCHEMBL14982182 | 0.84 | GSK3B (0.68) | KMT2AMEN1MAPTCYP3A4HPGD | |
| SCHEMBL2005451 | 0.83 | MEN1 (0.94) | KMT2AMEN1MAPTCYP3A4HPGD | |
| Dibenzoylmethane SCHEMBL11819811 | 0.83 | MEN1 (0.94) | KMT2AMEN1MAPTCYP3A4HPGD | |
| Dibenzoylmethane SCHEMBL27555185 | 0.83 | MEN1 (0.94) | KMT2AMEN1MAPTCYP3A4HPGD | |
| Dibenzoylmethane SCHEMBL28325880 | 0.83 | MEN1 (0.94) | KMT2AMEN1MAPTCYP3A4HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105254483-A | Method for preparing 2-methyl-1,3-dicarbonyl derivative | UNIV SOOCHOW | 2016-01-20 | — | — | CN | claimed |
| CN-105254483-B | A kind of method for preparing the Dicarbonyl derivatives of 2 methyl 1,3 | 苏州大学 | 2017-11-03 | — | — | CN | disclosed |
| CN-105254483-A | Method for preparing 2-methyl-1,3-dicarbonyl derivative | UNIV SOOCHOW | 2016-01-20 | — | — | CN | disclosed |