Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2594533 | 0.87 | NPC1 (0.53) | ALDH1A1KDM4EHTTGLAHPGD | |
| SCHEMBL3038469 | 0.82 | MAPT (0.56) | ALDH1A1KDM4EHTTL3MBTL1POLB | |
| SCHEMBL3044849 | 0.80 | LMNA (0.71) | KDM4ETSHRL3MBTL1POLBNPC1 | |
| SCHEMBL24479565 | 0.78 | HCRTR1 (0.57) | ALDH1A1KDM4EHTTGLAHPGD | |
| SCHEMBL31257960 | 0.78 | MAPT (0.53) | ALDH1A1KDM4ELMNATP53GAA | |
| SCHEMBL28261618 | 0.78 | MAPT (0.53) | ALDH1A1KDM4ELMNATP53GAA | |
| SCHEMBL1037365 | 0.75 | LMNA (0.65) | KDM4ETSHRL3MBTL1POLBNPC1 | |
| SCHEMBL15881788 | 0.73 | L3MBTL1 (0.64) | ALDH1A1KDM4EHPGDL3MBTL1POLB | |
| SCHEMBL4501943 | 0.73 | L3MBTL1 (0.64) | ALDH1A1HTTHPGDL3MBTL1NPC1 | |
| SCHEMBL13884195 | 0.73 | L3MBTL1 (0.64) | ALDH1A1HPGDL3MBTL1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011138265-A2 | INDOLE AND INDAZOLE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | claimed |
| WO-2011138265-A2 | INDOLE AND INDAZOLE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | disclosed |