Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 5/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | GLA | P06280 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | PKM | P14618 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.57 |
| ▸ | RELA | Q04206 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24332462 | 0.93 | APP (0.64) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL24331835 | 0.91 | APP (0.67) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL24332158 | 0.89 | APP (0.64) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL2133774 | 0.88 | APP (0.57) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL24332359 | 0.88 | APP (0.78) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL24332347 | 0.86 | APP (0.67) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL1638231 | 0.85 | APP (0.74) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL13816575 | 0.85 | APP (0.74) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL11079523 | 0.84 | KDM4E (0.60) | APPKDM4ESMN1; SMN2MAPTGLA | |
| SCHEMBL16080114 | 0.84 | KDM4E (0.60) | APPKDM4ESMN1; SMN2MAPTGLA |
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-109180590-A | A method of Benzoheterocyclic compounds are quickly prepared using physical grinding method under room temperature solvent-free | 福建医科大学 | 2019-01-11 | — | — | CN | disclosed |