Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL99091 | 0.95 | RAB9A (0.51) | NPC1RAB9AMAPTHPGDKMT2A | |
| SCHEMBL102612 | 0.91 | NPC1 (0.48) | NPC1RAB9AMAPTHPGDPOLB | |
| SCHEMBL99375 | 0.86 | NPC1 (0.49) | NPC1RAB9AMAPTHPGDPOLB | |
| SCHEMBL101634 | 0.86 | POLB (0.46) | NPC1RAB9AMAPTHPGDPOLB | |
| SCHEMBL100933 | 0.86 | POLB (0.46) | NPC1RAB9AMAPTHPGDPOLB | |
| SCHEMBL101227 | 0.85 | NPC1 (0.45) | NPC1RAB9AMAPTPOLBKMT2A | |
| SCHEMBL100326 | 0.85 | HCAR2 (0.46) | NPC1RAB9AMAPTPOLBKMT2A | |
| SCHEMBL99141 | 0.85 | NPC1 (0.48) | NPC1RAB9AMAPTHPGDPOLB | |
| SCHEMBL101223 | 0.85 | HDAC1 (0.51) | NPC1RAB9AMAPTPOLBKMT2A | |
| SCHEMBL98803 | 0.84 | POLB (0.50) | NPC1RAB9AMAPTHPGDPOLB |
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-2426121-A1 | QUATERNARY AMMONIUM SALT COMPOUND | Teijin Pharma Limited (JP) | 2012-03-07 | — | — | EP | claimed |