Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14464327 | 0.86 | NFE2L2 (0.53) | ALDH1A1NFE2L2TDP1DAOLOXL2 | |
| SCHEMBL16519838 | 0.80 | CEL (0.44) | DAO | |
| SCHEMBL386638 | 0.80 | MAOB (0.55) | SLC6A2ALDH1A1DAOSLC6A4SLC6A3 | |
| SCHEMBL16191644 | 0.80 | MAOB (0.55) | TAAR1CYP2A6CYP1A2KMT2ADAO | |
| SCHEMBL16499616 | 0.80 | DAO (0.45) | DAO | |
| SCHEMBL23396257 | 0.80 | MAOB (0.55) | TAAR1ALDH1A1DAOSMN1; SMN2 | |
| SCHEMBL13464692 | 0.80 | HDAC3 (0.44) | TAAR1HTR2AKMT2ADAO | |
| SCHEMBL21622788 | 0.80 | MAOB (0.55) | TAAR1SLC6A2ALDH1A1CYP2C19KMT2A | |
| SCHEMBL22337071 | 0.80 | HDAC3 (0.44) | TAAR1HTR2AKMT2ADAO | |
| SCHEMBL17070215 | 0.80 | HDAC3 (0.44) | TAAR1HTR2AKMT2ADAO |
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-5034381-A | Antagonist | CIBA-GEIGY CORPORATION (US) | 1991-07-23 | — | — | US | disclosed |