Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.46 |
| ▸ | ERN1 | O75460 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 9/20 | 0.41 |
| ▸ | HTT | P42858 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HSPB1 | P04792 | 2/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29953009 | 0.83 | ALDH1A1 (0.49) | MEN1KMT2AERN1MAPTALDH1A1 | |
| SCHEMBL3035666 | 0.83 | ALDH1A1 (0.49) | MEN1KMT2AERN1MAPTALDH1A1 | |
| SCHEMBL1851173 | 0.76 | KMT2A (0.70) | MEN1KMT2APABPC1ERN1MAPT | |
| SCHEMBL30850667 | 0.76 | KMT2A (0.70) | MEN1KMT2APABPC1ERN1MAPT | |
| SCHEMBL23166407 | 0.73 | TXNRD1 (0.47) | MAPTHTTMAPK1MTNR1AMTNR1B | |
| SCHEMBL30166982 | 0.73 | TXNRD1 (0.47) | MAPTHTTMAPK1MTNR1AMTNR1B | |
| SCHEMBL29954006 | 0.70 | CYP3A4 (0.43) | MEN1KMT2AERN1MAPTHTT | |
| SCHEMBL16835850 | 0.68 | KMT2A (0.59) | MEN1KMT2APABPC1ERN1MAPT | |
| SCHEMBL18285419 | 0.66 | KMT2A (0.57) | MEN1KMT2APABPC1MAPTLMNA | |
| SCHEMBL261553 | 0.66 | MEN1 (0.57) | MEN1KMT2APABPC1MAPTHTT |
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-2010030727-A1 | 3-SUBSTITUTED-1H-INDOLE, 3-SUBSTITUTED-1H-PYRROLO[2,3-B]PYRIDINE AND 3-SUBSTITUTED-1H-PYRROLO[3,2-B]PYRIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | WYETH LLC (US) | 2010-03-18 | — | — | WO | disclosed |