Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | OXTR | P30559 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31274754 | 1.00 | HPGD (0.39) | HPGDSMN1; SMN2LMNAAOC3HSD17B10 | |
| SCHEMBL25004559 | 0.84 | HPGD (0.39) | HPGDSMN1; SMN2LMNAAOC3HSD17B10 | |
| SCHEMBL17336545 | 0.79 | MAPT (0.46) | KDM4EMAPTS1PR1 | |
| SCHEMBL18479255 | 0.79 | LOX (0.38) | AOC3KDM4EMAPTL3MBTL1S1PR3 | |
| SCHEMBL22759822 | 0.79 | NQO2 (0.41) | LMNAMAPTALDH1A1L3MBTL1 | |
| SCHEMBL15382533 | 0.79 | UHRF1 (0.45) | HPGDAOC3HSD17B10GRM5KDM4E | |
| SCHEMBL20845882 | 0.78 | NNMT (0.46) | AOC3KDM4EMAPTHTTOXTR | |
| SCHEMBL30755821 | 0.78 | HSD17B10 (0.44) | HPGDSMN1; SMN2LMNAAOC3HSD17B10 | |
| SCHEMBL23663288 | 0.75 | MAPT (0.54) | SMN1; SMN2LMNAAOC3MAPK1MAPT | |
| SCHEMBL22978591 | 0.74 | SMN1; SMN2 (0.38) | HPGDSMN1; SMN2LMNAAOC3HSD17B10 |
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-2017153520-A1 | BENZOPIPERIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER AND HEMOGLOBINOPATHIES | CTXT PTY LIMITED (AU) | 2017-09-14 | — | — | WO | disclosed |