Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5464692 | 1.00 | CA2 (0.48) | CA2TRPA1CES2SLC6A4FAAH | |
| SCHEMBL5717938 | 1.00 | CA2 (0.48) | CA2TRPA1CES2SLC6A4FAAH | |
| SCHEMBL5461797 | 1.00 | CA2 (0.48) | CA2TRPA1CES2SLC6A4FAAH | |
| SCHEMBL5480651 | 1.00 | CA2 (0.48) | CA2TRPA1CES2SLC6A4FAAH | |
| SCHEMBL5471921 | 0.97 | TRPA1 (0.50) | CA2TRPA1CES2SLC6A4FAAH | |
| SCHEMBL5475260 | 0.90 | — | — | |
| SCHEMBL11029344 | 0.89 | TRPA1 (0.57) | CA2TRPA1CES2SLC6A4HDAC3 | |
| SCHEMBL11604930 | 0.89 | TRPA1 (0.57) | CA2TRPA1CES2SLC6A4HDAC3 | |
| SCHEMBL27944290 | 0.82 | CA2 (0.50) | CA2CES2FAAHTHRBCTSL | |
| SCHEMBL1709048 | 0.78 | — | — |
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-20070148721-A1 | Compositions, methods, systems, and kits for affinity purification | AGILENT TECHNOLOGIES, INC. (US) | 2007-06-28 | — | — | US | disclosed |
| WO-2006026416-A1 | COMPOSITIONS, METHODS, SYSTEMS, AND KITS FOR AFFINITY PURIFICATION | AGILENT TECHNOLOGIES, INC. (US) | 2006-03-09 | — | — | WO | disclosed |