Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3230254 | 1.00 | RAB9A (0.35) | RAB9AALDH1A1L3MBTL1POLBCASP3 | |
| SCHEMBL3210000 | 0.80 | CHRM3 (0.43) | RAB9AALDH1A1L3MBTL1CHRM3CHRM2 | |
| SCHEMBL1845152 | 0.77 | CHRM2 (0.32) | POLBCHRM3CHRM2CHRM1CYP2D6 | |
| SCHEMBL1845153 | 0.77 | CHRM2 (0.32) | POLBCHRM3CHRM2CHRM1CYP2D6 | |
| SCHEMBL3223141 | 0.68 | SLC6A2 (0.36) | RAB9AALDH1A1L3MBTL1CHRM3CYP2D6 | |
| SCHEMBL4740717 | 0.68 | CHRM3 (0.43) | RAB9AALDH1A1L3MBTL1CHRM3CHRM2 | |
| SCHEMBL4727371 | 0.68 | CHRM3 (0.43) | RAB9AALDH1A1L3MBTL1POLBCHRM3 | |
| SCHEMBL20176049 | 0.63 | MEN1 (0.36) | ALDH1A1POLBCHRM3CHRM2CHRM1 | |
| SCHEMBL1315214 | 0.62 | KEAP1 (0.44) | ALDH1A1L3MBTL1POLBCHRM3CHRM2 | |
| SCHEMBL9809468 | 0.62 | KEAP1 (0.46) | ALDH1A1POLBCHRM3CHRM2CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010018352-A1 | HETEROCYCLIC COMPOUNDS USED IN THE TREATMENT OF DISEASES WHERE ENHANCED M3 RECEPTOR ACTIVATION IS IMPLICATED | ARGENTA DISCOVERY LIMITED (GB) | 2010-02-18 | — | — | WO | disclosed |