Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | CD44 | P16070 | 1/20 | 0.46 |
| ▸ | RAPGEF4 | Q8WZA2 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL765882 | 0.88 | CYP3A4 (0.58) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL120848 | 0.82 | CD44 (0.61) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL29351204 | 0.80 | ALDH1A1 (0.61) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL180195 | 0.80 | ALDH1A1 (0.61) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| Water SCHEMBL29026586 | 0.78 | CD44 (0.58) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL2219302 | 0.76 | CD44 (0.55) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL168826 | 0.76 | CD44 (0.55) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL8261003 | 0.72 | CD44 (0.58) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL13176877 | 0.71 | CD44 (0.50) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL31519176 | 0.71 | CYP3A4 (0.59) | CYP3A4CHRM1ALOX15MAOATBXA2R |
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 |
|---|---|---|---|---|---|---|---|
| US-5138031-A | LINEAR AND BRANCHED POLY-P-ARYLENE SULFIDE SUBSTANTIALLY FREE FROM DEFECT STRUCTURES HAVING PLURAL ABSORPTION MAXIMA | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-11 | — | — | US | disclosed |
| EP-0373364-A2 | Hardly structurally faulty linear or branched poly-p-arylene sulfide, process for its preparation and its use | BAYER AG (DE) | 1990-06-20 | — | — | EP | disclosed |