Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16485964 | 0.84 | HTT (0.43) | ALDH1A1KMT2AMEN1HTTRAB9A | |
| SCHEMBL5369495 | 0.79 | AKR1C1 (0.46) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL30937544 | 0.79 | AKR1C1 (0.46) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL14938432 | 0.76 | MEN1 (0.42) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL31445078 | 0.76 | GAA (0.37) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL28040741 | 0.76 | KDM4E (0.49) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL17241125 | 0.75 | CYP1A2 (0.49) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL5368690 | 0.74 | AKR1C1 (0.49) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL31447055 | 0.72 | HDAC4 (0.39) | GAAPOLB | |
| SCHEMBL16515363 | 0.72 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1HTTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105431419-A | Novel aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection | HOFFMANN-LA ROCHE AG | 2016-03-23 | — | — | CN | disclosed |
| CN-105408330-A | Novel aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection | HOFFMANN LA ROCHE | 2016-03-16 | — | — | CN | disclosed |