Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26181018 | 0.72 | GAA (0.51) | METGAAPKMALDH1A1POLB | |
| SCHEMBL11059173 | 0.71 | KMT2A (0.43) | GAAPKMALDH1A1POLBLMNA | |
| SCHEMBL26054592 | 0.70 | PPME1 (0.46) | METPKMALDH1A1LMNAMEN1 | |
| SCHEMBL6534916 | 0.69 | KMT2A (0.61) | METGAAPKMALDH1A1POLB | |
| SCHEMBL26054490 | 0.68 | RAPGEF4 (0.52) | GAAPKMALDH1A1POLBMEN1 | |
| SCHEMBL9229231 | 0.68 | KMT2A (0.33) | ALDH1A1KMT2ANPC1 | |
| SCHEMBL2360974 | 0.66 | ALDH1A1 (0.84) | PKMALDH1A1POLBLMNAMEN1 | |
| SCHEMBL18794812 | 0.65 | ALDH1A1 (0.69) | PKMALDH1A1POLBLMNAACHE | |
| SCHEMBL12719289 | 0.65 | KMT2A (0.66) | PKMALDH1A1POLBLMNAACHE | |
| SCHEMBL14477865 | 0.65 | PKM (0.69) | GAAPKMALDH1A1POLBLMNA |
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 |