Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.49 |
| ▸ | SNCA | P37840 | 1/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.47 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.47 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9910661 | 0.86 | HDAC3 (0.46) | IRAK4SNCAERBB2MAPTSMN1; SMN2 | |
| SCHEMBL7977921 | 0.82 | KDM4E (0.50) | SNCASMN1; SMN2CACNA1GCACNA1HCACNA1I | |
| SCHEMBL1645807 | 0.82 | GSK3B (0.46) | IRAK4SNCAMAPTCACNA1GCACNA1H | |
| SCHEMBL760076 | 0.81 | CA1 (0.47) | SNCASMN1; SMN2CACNA1GCACNA1HCACNA1I | |
| SCHEMBL7977927 | 0.80 | HDAC6 (0.49) | SNCACACNA1GCACNA1HCACNA1IL3MBTL1 | |
| SCHEMBL1163484 | 0.78 | CACNA1G (0.45) | IRAK4SNCAERBB2MAPTCACNA1G | |
| SCHEMBL27750270 | 0.78 | KMT2A (0.46) | SNCACACNA1GCACNA1HCACNA1INPC1 | |
| SCHEMBL7988907 | 0.78 | THRB (0.50) | SNCAMAPTKDM4EL3MBTL1ADORA3 | |
| SCHEMBL662061 | 0.77 | IDO1 (0.45) | ERBB2MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL17602073 | 0.76 | MAPT (0.54) | ERBB2MAPTSMN1; SMN2CACNA1GCACNA1H |
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 |
|---|---|---|---|---|---|---|---|
| EP-2464228-A1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | Merck Sharp & Dohme Corp. (US) | 2012-06-20 | — | — | EP | disclosed |