Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7387682 | 1.00 | NPC1 (0.42) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL22454599 | 0.82 | TDP1 (0.50) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL4727500 | 0.78 | KMT2A (0.53) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL30764064 | 0.74 | KMT2A (0.54) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL14282039 | 0.72 | TDP1 (0.46) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL4521331 | 0.72 | L3MBTL1 (0.47) | NPC1KMT2AMEN1RAB9ATDP1 | |
| SCHEMBL1629317 | 0.72 | TDP1 (0.56) | NPC1KMT2AMEN1RAB9ATDP1 | |
| Hydrocinnamyl Alcohol SCHEMBL28142660 | 0.72 | TAAR1 (0.51) | NPC1KMT2ARAB9ATDP1TAAR1 | |
| Hydrocinnamyl Alcohol SCHEMBL28142659 | 0.71 | TAAR1 (0.50) | NPC1KMT2ARAB9ATDP1TAAR1 | |
| SCHEMBL4522760 | 0.70 | SMN1; SMN2 (0.43) | NPC1KMT2AMEN1RAB9ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5409929-A | Treating psychosis, dyskinesia | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-04-25 | — | — | US | disclosed |
| US-5216018-A | Antidyskinetic agents | DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-06-01 | — | — | US | disclosed |