Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 12/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 12/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 12/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5841607 | 0.88 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6KMT2A | |
| SCHEMBL16296491 | 0.77 | PPARG (0.36) | MAOAMAOBADAM17KMT2ALMNA | |
| SCHEMBL27788413 | 0.77 | MAOA (0.40) | CYP2D6MAOAMAOB | |
| SCHEMBL28012199 | 0.75 | DDB1 (0.41) | SLC6A2SLC6A3KMT2ALMNA | |
| SCHEMBL28326929 | 0.73 | KDM4E (0.34) | KMT2A | |
| SCHEMBL8862591 | 0.72 | ALPI (0.44) | SLC6A2SLC6A4SLC6A3ALPIPKM | |
| SCHEMBL20236439 | 0.72 | HDAC8 (0.37) | SLC6A2SLC6A4SLC6A3MAOAKMT2A | |
| SCHEMBL2447412 | 0.72 | HTR2A (0.39) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL9528556 | 0.72 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CYP2D6MAOA | |
| SCHEMBL4557427 | 0.71 | ALDH1A1 (0.35) | SLC6A2SLC6A4SLC6A3LMNA |
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-2362775-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2011-09-07 | — | — | EP | disclosed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | disclosed |