Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL1135994 | 0.81 | CTSD (0.49) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL31253855 | 0.78 | LMNA (0.48) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL28132009 | 0.76 | FAAH (0.56) | CTSDHTTLMNAIRAK4NPC1 | |
| SCHEMBL3827916 | 0.76 | LMNA (0.52) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL10690271 | 0.75 | CYP2C9 (0.46) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL11332072 | 0.75 | HDAC1 (0.48) | CTSDHTTLMNANPC1RAB9A | |
| SCHEMBL22023790 | 0.74 | HTT (0.45) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL28348830 | 0.74 | HPGD (0.50) | CTSDHTTLMNAIRAK4NPC1 | |
| SCHEMBL13450279 | 0.74 | LMNA (0.48) | CTSDHTTLMNAADORA2AADORA2B | |
| SCHEMBL22023936 | 0.73 | CTSD (0.44) | CTSDHTTLMNAADORA2AADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3099694-A1 | COMPOUNDS | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2016-12-07 | — | — | EP | disclosed |
| WO-2015113451-A1 | COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2015-08-06 | — | — | WO | disclosed |