Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 5/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19597347 | 0.72 | ADORA2A (0.69) | ADORA2AADORA2BESR1KDM4CKDM4E | |
| SCHEMBL15792006 | 0.70 | ADORA2A (0.47) | ADORA2AADORA2BESR1KDM4CKDM4E | |
| SCHEMBL23739435 | 0.69 | DYRK1A (0.43) | ADORA2AADORA2BKDM4EALDH1A1MAPT | |
| SCHEMBL20116573 | 0.68 | ADORA2A (0.67) | ADORA2AADORA2BESR1KDM4CSMN1; SMN2 | |
| SCHEMBL20053835 | 0.68 | ADORA2A (0.43) | ADORA2AADORA2BESR1KDM4EALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL905842 | 0.67 | ADORA2A (0.59) | ADORA2AADORA2BESR1KMOATM | |
| SCHEMBL14928200 | 0.67 | ADORA2A (0.65) | ADORA2AADORA2BESR1KDM4EALDH1A1 | |
| SCHEMBL16682174 | 0.67 | ADORA2A (0.65) | ADORA2AADORA2BESR1KDM4CKMO | |
| SCHEMBL22369310 | 0.66 | ADORA2A (0.43) | ADORA2AADORA2BESR1KDM4CKDM4E | |
| SCHEMBL19911484 | 0.66 | SLC9A1 (0.62) | ALDH1A1KMT2AMEN1TLR8CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1780612-B | Treatment of incontinence with 5HT2C agonists. | PFIZER | 2010-12-01 | — | — | CN | disclosed |
| CN-1780612-A | Treatment of incontinence with 5HT2C agonists. | PFIZER (US) | 2006-05-31 | — | — | CN | disclosed |