Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3804631 | 0.83 | PDE2A (0.53) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL3753277 | 0.82 | MAPK1 (0.47) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL3752771 | 0.80 | MAPK1 (0.35) | ALDH1A1KDM4EHPGDLMNAMAPK1 | |
| SCHEMBL4826028 | 0.77 | KDM4E (0.50) | ALDH1A1KDM4EHPGDGAALMNA | |
| SCHEMBL3808604 | 0.75 | KDM4E (0.42) | ALDH1A1KDM4EHPGDGAACYP3A4 | |
| SCHEMBL3641920 | 0.74 | KDM4E (0.44) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL9423136 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDCYP1A2LMNA | |
| SCHEMBL13728897 | 0.74 | MAPT (0.43) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL18435335 | 0.74 | MAPK1 (0.41) | ALDH1A1KDM4EHPGDGAACYP1A2 | |
| SCHEMBL3512793 | 0.73 | KDM4E (0.50) | ALDH1A1KDM4EHPGDGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2185537-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | Pfizer Inc. (US) | 2010-05-19 | — | — | EP | disclosed |
| WO-2009016498-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | PFIZER INC. (US) | 2009-02-05 | — | — | WO | disclosed |