Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3944054 | 0.95 | MAPT (0.41) | MAPTNPSR1RXFP1HSD17B10ALDH1A1 | |
| SCHEMBL3934781 | 0.89 | SMN1; SMN2 (0.44) | MAPTNPSR1RXFP1HSD17B10SMN1; SMN2 | |
| SCHEMBL31306041 | 0.85 | MAPT (0.49) | MAPTNPSR1RXFP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL4644440 | 0.85 | MAPT (0.49) | MAPTNPSR1RXFP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL12284065 | 0.83 | ALDH1A1 (0.40) | HSD17B10ALDH1A1KDM4EKMT2ATDP1 | |
| SCHEMBL29555685 | 0.79 | MAPT (0.50) | MAPTNPSR1RXFP1HSD17B10SMN1; SMN2 | |
| SCHEMBL1029688 | 0.79 | MAPT (0.50) | MAPTNPSR1RXFP1HSD17B10SMN1; SMN2 | |
| SCHEMBL2557810 | 0.79 | ATM (0.38) | HSD17B10SMN1; SMN2ALDH1A1KDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL28435046 | 0.78 | MAPT (0.49) | MAPTNPSR1RXFP1HSD17B10SMN1; SMN2 | |
| SCHEMBL13315467 | 0.76 | ALDH1A1 (0.47) | MAPTNPSR1HSD17B10SMN1; SMN2ALDH1A1 |
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-2009013333-A1 | ALKYLACETYLENE SUBSTITUTED ACYLTRYPTOPHANOLS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-01-29 | — | — | WO | disclosed |
| EP-2019102-A1 | Alkylacetylene substituted Acyltryptophanols | Bayer Schering Pharma AG (DE) | 2009-01-28 | — | — | EP | disclosed |