Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.67 |
| ▸ | GLA | P06280 | 6/20 | 0.67 |
| ▸ | GAA | P10253 | 5/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.67 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | CASP1 | P29466 | 3/20 | 0.47 |
| ▸ | CASP7 | P55210 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11549158 | 0.84 | KDM4E (0.74) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL28355495 | 0.82 | KDM4E (0.67) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL28351806 | 0.82 | KDM4E (0.67) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL8969253 | 0.82 | HTR6 (0.43) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL28355625 | 0.81 | KDM4E (0.61) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL20075338 | 0.81 | KDM4E (0.69) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL2427657 | 0.80 | KDM4E (1.00) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL11569234 | 0.80 | KDM4E (0.68) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL30228536 | 0.79 | KDM4E (0.96) | KDM4EALDH1A1GLAGAASMN1; SMN2 | |
| SCHEMBL28355423 | 0.78 | ALDH1A1 (0.61) | KDM4EALDH1A1GLAGAASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110252351-B | Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite | 苏州大学 | 2021-12-10 | — | — | CN | disclosed |
| CN-107698586-B | Method for preparing pyridoquinazolinone compound by catalysis of copper compound | 广州大学 | 2020-02-07 | — | — | CN | disclosed |