Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | F13A1 | P00488 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | TGM1 | P22735 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TBK1 | Q9UHD2 | 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 | |
|---|---|---|---|---|
| SCHEMBL9963092 | 0.80 | CYP3A4 (0.48) | CYP3A4CYP3A5GPR119HTTATM | |
| SCHEMBL660699 | 0.77 | HTT (0.51) | CYP3A4CYP3A5GPR119HTTATM | |
| SCHEMBL3837657 | 0.77 | HTT (0.51) | CYP3A4CYP3A5GPR119HTTATM | |
| SCHEMBL3837654 | 0.77 | HTT (0.51) | CYP3A4CYP3A5GPR119HTTATM | |
| SCHEMBL18249594 | 0.76 | DPP4 (0.42) | CYP3A4CYP3A5DPP4GPR119SMN1; SMN2 | |
| SCHEMBL18249625 | 0.76 | DPP4 (0.42) | DPP4GPR119MAPTSMN1; SMN2 | |
| SCHEMBL28483062 | 0.74 | CYP3A4 (0.52) | CYP3A4CYP3A5DPP4GPR119MAPT | |
| SCHEMBL1865523 | 0.73 | SMN1; SMN2 (0.40) | CYP3A4CYP3A5DPP4GPR119ALDH1A1 | |
| SCHEMBL1865525 | 0.73 | SMN1; SMN2 (0.40) | CYP3A4CYP3A5DPP4GPR119ALDH1A1 | |
| SCHEMBL31647258 | 0.73 | CYP3A4 (0.56) | CYP3A4CYP3A5DPP4HTTNPC1 |
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-2008134036-A1 | ALPHA-SUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-α]PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |