Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9819098 | 0.93 | NPC1 (0.44) | MAPK1NPC1RAB9ACASP3SENP7 | |
| SCHEMBL9819218 | 0.93 | NPC1 (0.43) | MAPK1NPC1RAB9ACASP3SENP7 | |
| SCHEMBL9819109 | 0.90 | KMT2A (0.49) | NPC1RAB9ACASP3SENP7KMT2A | |
| SCHEMBL9819336 | 0.90 | RAB9A (0.49) | MAPK1NPC1RAB9ACASP3SENP7 | |
| SCHEMBL9819360 | 0.90 | RAPGEF3 (0.43) | MAPK1NPC1RAB9ACASP3SENP7 | |
| SCHEMBL9818807 | 0.81 | APP (0.52) | MAPK1NPC1RAB9AKMT2APOLB | |
| SCHEMBL9819129 | 0.79 | KMT2A (0.54) | NPC1RAB9ASMN1; SMN2KMT2APOLB | |
| SCHEMBL9819106 | 0.78 | MEN1 (0.52) | MAPK1NPC1RAB9AKMT2APOLB | |
| SCHEMBL9818887 | 0.77 | IDO1 (0.47) | RAB9AKMT2APOLBMEN1ALDH1A1 | |
| SCHEMBL9819086 | 0.76 | RAPGEF3 (0.40) | RAB9AKMT2AMEN1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5034410-A | Nitrile and oxo containing amides or thioamides | SYNTEX (U.S.A.) INC. (US) | 1991-07-23 | — | — | US | disclosed |