Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 7/20 | 0.55 |
| ▸ | CES1 | P23141 | 7/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.43 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28442996 | 0.95 | CES2 (0.61) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL5034136 | 0.86 | ALDH1A1 (0.41) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL183337 | 0.82 | CES1 (0.52) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL27448436 | 0.82 | CES2 (0.52) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL6934724 | 0.82 | ALDH1A1 (0.67) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL19810344 | 0.82 | ALDH1A1 (0.67) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL6929642 | 0.80 | CES1 (0.50) | CES2CES1ALDH1A1HDAC3HDAC1 | |
| SCHEMBL21114377 | 0.79 | CES1 (0.65) | CES2CES1ALDH1A1TSHRFAAH | |
| SCHEMBL10996293 | 0.79 | — | — | |
| SCHEMBL105956 | 0.77 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020155192-A1 | Yeast transport isoforms | MEDICAL RESEARCH COUNCIL (GB) | 2002-10-24 | — | — | US | disclosed |
| EP-1207846-A1 | TOWELETTE PRODUCT | UNILEVER PLC (GB) | 2002-05-29 | — | — | EP | disclosed |
| WO-2002010395-A1 | ISOFORMS OF AN OXODICARBOXYLATES TRANSPORTER OF S. CEREVISIAE | MEDICAL RESEARCH COUNCIL (GB) | 2002-02-07 | — | — | WO | disclosed |
| WO-2001013880-A1 | TOWELETTE PRODUCT | UNILEVER PLC (GB) | 2001-03-01 | — | — | WO | disclosed |