Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL167447 | 0.73 | CES2 (0.64) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL1990301 | 0.72 | CES2 (0.55) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL7924194 | 0.69 | CES2 (0.50) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL28929064 | 0.67 | CYP3A4 (0.48) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL27653331 | 0.67 | CES2 (0.70) | CES2CES1TDP1KMT2ALMNA | |
| Iodide SCHEMBL6190800 | 0.67 | CES2 (0.48) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL467416 | 0.67 | THRB (0.71) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL27763941 | 0.67 | CES2 (0.54) | CES2CES1TDP1KMT2ALMNA | |
| SCHEMBL12160758 | 0.67 | CES2 (0.54) | CES2CES1TDP1KMT2ALMNA | |
| Acetamide SCHEMBL4743556 | 0.67 | CES2 (0.54) | CES2CES1TDP1KMT2ALMNA |
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-2008003703-A1 | INDOLES AS 5-HT6 MODULATORS | BIOVITRUM AB (PUBL) (SE) | 2008-01-10 | — | — | WO | disclosed |