Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SCN1A | P35498 | 3/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | HRH2 | P25021 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2839765 | 0.85 | HTT (0.41) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL7718706 | 0.79 | IDO1 (0.42) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL15803228 | 0.78 | IDO1 (0.38) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL28431726 | 0.76 | IDO1 (0.40) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL10141173 | 0.74 | IDO1 (0.36) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL1065153 | 0.74 | IDO1 (0.40) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL23532328 | 0.73 | IDO1 (0.36) | HTTSCN1ASCN2ASCN3ACHRM2 | |
| SCHEMBL2843916 | 0.73 | PTGS2 (0.42) | SMN1; SMN2 | |
| SCHEMBL6282856 | 0.72 | THRB (0.39) | HTTADRA2ASLC6A2SLC6A3LMNA | |
| SCHEMBL1417280 | 0.72 | THRB (0.39) | HTTADRA2ASLC6A2SLC6A3LMNA |
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-6376615-B1 | USING FREE RADICALS | CENTRO DE INVESTIGACION EN QUIMICA APLICADA (MX) | 2002-04-23 | — | — | US | claimed |
| US-6376615-B1 | USING FREE RADICALS | CENTRO DE INVESTIGACION EN QUIMICA APLICADA (MX) | 2002-04-23 | — | — | US | disclosed |