Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.39 |
| ▸ | FOS | P01100 | 2/20 | 0.39 |
| ▸ | JUN | P05412 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7994780 | 0.84 | MAOB (0.53) | S1PR1POLBSMN1; SMN2HTTKDM4E | |
| SCHEMBL7989163 | 0.83 | PTPN11 (0.48) | TP53LMNAMAPK1 | |
| SCHEMBL7994778 | 0.83 | SLC2A1 (0.41) | S1PR1S1PR3MAPTHPGDSMN1; SMN2 | |
| SCHEMBL7991327 | 0.82 | KDM4E (0.52) | MAPTHPGDKDM4EALDH1A1MAPK1 | |
| SCHEMBL7995609 | 0.82 | S1PR1 (0.40) | S1PR1S1PR3SMN1; SMN2KDM4ELMNA | |
| SCHEMBL7987979 | 0.80 | PPARA (0.46) | S1PR1S1PR3MAPTSMN1; SMN2KDM4E | |
| SCHEMBL7988818 | 0.80 | MAOB (0.48) | MAPTPOLBTP53SMN1; SMN2NPSR1 | |
| SCHEMBL7991609 | 0.77 | MAOB (0.49) | POLBTP53SMN1; SMN2RXFP1 | |
| SCHEMBL7989235 | 0.74 | ACHE (0.48) | MAPTHPGDTP53SMN1; SMN2KDM4E | |
| SCHEMBL16526411 | 0.72 | MAPT (0.67) | ABCB1MAPTPOLBHPGDXBP1 |
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-2001055117-A1 | NOVEL ISOQUINOLINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LES LABORATOIRES SERVIER (FR) | 2001-08-02 | — | — | WO | disclosed |