Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.54 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.54 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27505319 | 1.00 | ALDH1A1 (0.60) | ALDH1A1LPAR2LPAR1LPAR3CYP2C19 | |
| SCHEMBL7824235 | 1.00 | ALDH1A1 (0.60) | ALDH1A1LPAR2LPAR1LPAR3CYP2C19 | |
| SCHEMBL27505320 | 0.85 | LMNA (0.51) | ALDH1A1CYP2C19GAAALOX15TSHR | |
| SCHEMBL10950830 | 0.81 | KDM4E (0.65) | ALDH1A1LPAR2LPAR3CYP2C19GAA | |
| SCHEMBL30764108 | 0.81 | KDM4E (0.65) | ALDH1A1LPAR2LPAR3CYP2C19GAA | |
| SCHEMBL9558740 | 0.79 | CACNA1C (0.51) | ALDH1A1CYP2C19ALOX15TSHRHIF1A | |
| SCHEMBL9354277 | 0.79 | ALDH1A1 (0.64) | ALDH1A1LPAR2LPAR1LPAR3CYP2C19 | |
| SCHEMBL9354265 | 0.79 | ALDH1A1 (0.64) | ALDH1A1LPAR2LPAR1LPAR3CYP2C19 | |
| SCHEMBL17873434 | 0.76 | CYP2C19 (0.50) | ALDH1A1CYP2C19ALOX15TSHRHIF1A | |
| SCHEMBL17873435 | 0.76 | CYP2C19 (0.50) | ALDH1A1CYP2C19ALOX15TSHRHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |