Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL11250158 | 1.00 | KDM4E (0.50) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL972563 | 0.97 | KDM4E (0.46) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL1616084 | 0.97 | — | — | |
| SCHEMBL1314968 | 0.91 | ALDH1A1 (0.54) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL22911174 | 0.91 | ALDH1A1 (0.54) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| Methane SCHEMBL10746573 | 0.88 | ALDH1A1 (0.52) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL8679860 | 0.88 | HRH3 (0.50) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL3429603 | 0.88 | KDM4E (0.41) | KDM4EALDH1A1KMT2AMEN1HRH3 | |
| SCHEMBL11483699 | 0.88 | — | — | |
| SCHEMBL5661986 | 0.87 | ALDH1A1 (0.71) | KDM4EALDH1A1HRH3LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4323550-A | DENTISTRY PREVENTION OF CAVITIES | GOUPIL JEAN JACQUES | 1982-04-06 | — | — | US | claimed |