Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.43 |
| ▸ | NT5E | P21589 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10358111 | 0.87 | ALDH1A1 (0.37) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL5720587 | 0.79 | APEX1 (0.56) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL4808201 | 0.78 | ALDH1A1 (0.72) | ALDH1A1HPGDTRPV1KDM4EMEN1 | |
| SCHEMBL5720540 | 0.78 | NT5E (0.65) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL5720688 | 0.77 | NT5E (0.45) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL5720624 | 0.77 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL11426651 | 0.76 | CASP6 (0.40) | CYP1A2CYP2C9CYP2C19ALDH1A1TRPV1 | |
| SCHEMBL11426061 | 0.76 | CASP6 (0.40) | CYP1A2CYP2C9CYP2C19ALDH1A1TRPV1 | |
| SCHEMBL9333192 | 0.76 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD | |
| SCHEMBL28785155 | 0.75 | NLRP3 (0.56) | CYP1A2CYP2C9CYP2C19ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1091958-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001692-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2000-01-13 | — | — | WO | disclosed |
| EP-0113860-B1 | PREPARATION PROCESS OF AZO DYES | BAYER AG (DE) | 1986-04-09 | — | — | EP | disclosed |