Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FADS1 | O60427 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL16235109 | 0.81 | ALDH1A1 (0.48) | ACLYSMN1; SMN2HSD17B10FABP4ALDH1A1 | |
| SCHEMBL8189051 | 0.76 | ACLY (0.46) | ACLYRAPGEF4ALDH1A1 | |
| SCHEMBL17900455 | 0.70 | PPME1 (0.49) | METSMN1; SMN2AKR1C3ALDH1A1LMNA | |
| SCHEMBL28974658 | 0.69 | POLB (0.41) | L3MBTL1 | |
| SCHEMBL11492285 | 0.69 | KDM4E (0.50) | RECQLKDM4ELMNA | |
| SCHEMBL14399002 | 0.68 | FABP4 (0.36) | FABP4RAPGEF4ALDH1A1LMNATSHR | |
| SCHEMBL1755039 | 0.67 | TSHR (0.48) | CDC25BRECQLSMN1; SMN2HSD17B10MAPK1 | |
| SCHEMBL22920078 | 0.66 | POLB (0.36) | FABP4RAPGEF4ALOX15L3MBTL1 | |
| SCHEMBL15651913 | 0.66 | ALDH1A1 (0.73) | SMN1; SMN2KDM4EMAPK1ALDH1A1LMNA | |
| SCHEMBL7696317 | 0.66 | ALDH1A1 (0.56) | GAASMN1; SMN2KDM4EMAPK1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996033171-A1 | 1H-PYRROL-1-YL AND 1H-INDOL-1-YL ARYL SULPHONES, PROCESSES FOR THEIR PREPARATION AND USE FOR THE THERAPY OF HIV-1 INFECTIONS | ISTITUTO SUPERIORE DI SANITÁ (IT) | 1996-10-24 | — | — | WO | disclosed |