Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 11/20 | 0.39 |
| ▸ | RAB9A | P51151 | 11/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SCD | O00767 | 1/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12479961 | 0.85 | HCRTR2 (0.43) | HCRTR2GAATP53MEN1KMT2A | |
| SCHEMBL16612707 | 0.78 | NPC1 (0.39) | HCRTR2NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL16612601 | 0.78 | DDAH1 (0.50) | NPC1RAB9AGAASMN1; SMN2ALDH1A1 | |
| SCHEMBL16612923 | 0.78 | LTA4H (0.43) | HCRTR2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL16612710 | 0.77 | KDM4E (0.49) | HCRTR2NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL16612683 | 0.76 | FDPS (0.45) | HCRTR2 | |
| SCHEMBL4686905 | 0.70 | NPC1 (0.51) | NPC1RAB9AGAASMN1; SMN2TP53 | |
| SCHEMBL12479677 | 0.70 | HCRTR2 (0.47) | HCRTR2NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL16612915 | 0.70 | APAF1 (0.45) | SMN1; SMN2TP53ALDH1A1KMT2ATDP1 | |
| SCHEMBL16612739 | 0.69 | TDP1 (0.54) | NPC1SMN1; SMN2ALDH1A1TDP1KDM4E |
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-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |