Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | VDR | P11473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9001459 | 1.00 | CYP2D6 (0.47) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL8744478 | 0.75 | CYP2D6 (0.60) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL6198035 | 0.75 | CYP2D6 (0.63) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL2670048 | 0.75 | CYP2D6 (0.63) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL8744470 | 0.75 | CYP2D6 (0.60) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL8744474 | 0.75 | CYP2D6 (0.60) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL6198029 | 0.75 | CYP2D6 (0.63) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL14779900 | 0.75 | CYP2D6 (0.60) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL777214 | 0.75 | CYP2D6 (0.63) | CYP2D6CYP1A2KMT2ASMN1; SMN2CYP3A4 | |
| SCHEMBL14780218 | 0.74 | CYP2D6 (0.64) | CYP2D6CYP1A2HTR6KMT2ASMN1; SMN2 |
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-0294934-B1 | Diastereomeric 5R,6S-6-(1R-hydroxyethyl)-2-(cis-1-oxo-3-thiolanylthio)-2-penem-3-carboxylic acids | PFIZER (US) | 1996-01-10 | — | — | EP | disclosed |
| EP-0338735-A1 | Process for optically active 3-(methane-sulfonyloxy)thioland and analogs | PFIZER INC. (US) | 1989-10-25 | — | — | EP | disclosed |
| EP-0294934-A2 | Diastereomeric 5R,6S-6-(1R-hydroxyethyl)-2-(cis-1-oxo-3-thiolanylthio)-2-penem-3-carboxylic acids | PFIZER INC. (US) | 1988-12-14 | — | — | EP | disclosed |