Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | CSF1R | P07333 | 1/20 | 0.46 |
| ▸ | PRKACA | P17612 | 1/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7471559 | 0.84 | CAPN1 (0.54) | ALDH1A1MLYCDHPGDMEN1KMT2A | |
| SCHEMBL7462269 | 0.83 | ALDH1A1 (0.55) | ALDH1A1MLYCDHPGDLMNAMEN1 | |
| SCHEMBL21950313 | 0.81 | MLYCD (0.60) | MAOAMAOBPTGS2KDM4EMPO | |
| SCHEMBL27474092 | 0.79 | CYP19A1 (0.51) | ALDH1A1CAPN1SMN1; SMN2 | |
| SCHEMBL7465046 | 0.77 | MMP2 (0.55) | ALDH1A1HPGDLMNAMEN1KMT2A | |
| SCHEMBL23303692 | 0.77 | CA2 (0.62) | MAOAMAOBPTGS2KDM4EALDH1A1 | |
| SCHEMBL23303693 | 0.77 | CA2 (0.62) | MAOAMAOBPTGS2KDM4EALDH1A1 | |
| SCHEMBL16257896 | 0.76 | MAOA (0.51) | MAOAMAOBPTGS2KDM4EMPO | |
| SCHEMBL27475408 | 0.76 | PSMB1 (0.53) | NAMPT | |
| SCHEMBL27515259 | 0.76 | MAOA (0.47) | MAOAMAOBPTGS2KDM4EMPO |
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 |
|---|---|---|---|---|---|---|---|
| CN-1177293-A | Method for inhibiting cathepsin K | SMITHKLINE BEECHAM CORP (US) | 1998-03-25 | — | — | CN | disclosed |