Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 5/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 5/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818593 | 0.97 | DPP4 (0.34) | DPP4CRHR1DGAT1GSK3AGSK3B | |
| SCHEMBL6821651 | 0.76 | LNPEP (0.35) | CRHR1ALDH1A1 | |
| SCHEMBL6083078 | 0.70 | CRHR1 (0.39) | DPP4CRHR1GSK3AGSK3BDYRK1A | |
| SCHEMBL6082401 | 0.68 | CRHR1 (0.38) | CRHR1KDM4E | |
| SCHEMBL14450812 | 0.60 | MEN1 (0.51) | FAAH | |
| SCHEMBL2868496 | 0.58 | HSP90AB1 (0.49) | DPP4CRHR1HSP90AA1HSP90AB1KDM4E | |
| SCHEMBL13300167 | 0.58 | DPP4 (0.40) | DPP4ALOX5APFEN1HSP90AA1HSP90AB1 | |
| SCHEMBL6049492 | 0.58 | HSP90AB1 (0.56) | DPP4GSK3AGSK3BDYRK1ACLK4 | |
| SCHEMBL1867374 | 0.57 | DPP4 (0.46) | DPP4HSP90AA1HSP90AB1KDM4EMGAM | |
| SCHEMBL3814809 | 0.57 | HSP90AB1 (0.45) | DPP4CRHR1HSP90AA1HSP90AB1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004031189-A1 | PYRIDINO AND PYRIMIDINO PYRAZINONES FOR TREATMENT OF ANXIETY AND DEPRESSION | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2004-04-15 | — | — | WO | disclosed |