Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK7 | P49862 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7494122 | 0.84 | HDAC6 (0.49) | ROCK2MAPTKMT2A | |
| SCHEMBL7976749 | 0.79 | HDAC3 (0.43) | ROCK2MAPTRAB9A | |
| SCHEMBL7502239 | 0.76 | LTA4H (0.45) | KLK7ROCK2ALDH1A1MAPTRAB9A | |
| SCHEMBL7495177 | 0.75 | MAPT (0.46) | MAPT | |
| SCHEMBL5871129 | 0.70 | RPLP1 (0.42) | — | |
| SCHEMBL7500121 | 0.70 | LTA4H (0.41) | KLK7MAPT | |
| SCHEMBL8605379 | 0.69 | RAB9A (0.72) | KLK7ALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL6508976 | 0.69 | KMT2A (0.67) | KLK7ROCK2ALDH1A1MAPTRAB9A | |
| SCHEMBL25194769 | 0.68 | HPGD (0.63) | ALDH1A1MAPTRAB9ASMN1; SMN2KMT2A | |
| SCHEMBL31329284 | 0.67 | ALDH1A1 (0.69) | KLK7ALDH1A1MAPTRAB9ASMN1; SMN2 |
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-2002069895-A2 | HETEROCYCLIC ANALGESIC COMPOUNDS AND METHODS OF USE THEREOF | SEPRACOR, INC. (US) | 2002-09-12 | — | — | WO | disclosed |