Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL3870753 | 1.00 | CES2 (0.47) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL673560 | 1.00 | CES2 (0.47) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL1858120 | 1.00 | CES2 (0.47) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL17801457 | 0.97 | CES2 (0.45) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL3881584 | 0.96 | CES2 (0.42) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL6272207 | 0.93 | CES2 (0.40) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL9830137 | 0.93 | CES2 (0.40) | CES2CES1MGLLHDAC8HDAC6 | |
| SCHEMBL7827736 | 0.89 | NOS2 (0.40) | CES2CES1MGLLNOS2CTSK | |
| SCHEMBL985067 | 0.86 | — | — | |
| SCHEMBL4203062 | 0.81 | — | — |
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-2005037857-A2 | METHOD OF PROTEIN ANALYSIS BY MALDI USING PROTEIN FRAGMENTATION WITH PEROXYCARBONATES | VANDERBILT UNIVERSITY (US) | 2005-04-28 | — | — | WO | disclosed |