Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8895881 | 0.89 | CYP2C19 (0.66) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL9621935 | 0.84 | CYP2C19 (0.64) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL22912362 | 0.83 | CYP2C19 (0.44) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL9069764 | 0.83 | CYP2C19 (0.57) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL17045918 | 0.81 | CYP2C19 (0.56) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL5935770 | 0.80 | CYP2C19 (0.68) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL560042 | 0.80 | MAPK1 (0.59) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL9622180 | 0.79 | CYP2C19 (0.62) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL1259772 | 0.78 | TDP1 (0.56) | ALDH1A1LMNAHTTMAPTFFAR1 | |
| SCHEMBL8038243 | 0.78 | CYP1A2 (0.54) | CYP2C19ALDH1A1HPGDLMNASMN1; SMN2 |
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-5859011-A | Dihydropyridine derivatives as bradykinin antagonist | PFIZER INC. (US) | 1999-01-12 | — | — | US | disclosed |