Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CES2 | O00748 | 5/20 | 0.38 |
| ▸ | CES1 | P23141 | 5/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 6/20 | 0.35 |
| ▸ | PPARG | P37231 | 6/20 | 0.34 |
| ▸ | PPARD | Q03181 | 6/20 | 0.34 |
| ▸ | PPARA | Q07869 | 6/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.34 |
| ▸ | TLR2 | O60603 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.34 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL9412419 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL15529777 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL15529767 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL15529876 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL674337 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL15529628 | 0.98 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL78640 | 0.93 | ALDH1A1 (0.44) | ALDH1A1CES2CES1FAAHAKR1B1 | |
| SCHEMBL8837576 | 0.90 | ALDH1A1 (0.39) | ALDH1A1CES2CES1FAAHTSHR | |
| SCHEMBL11301675 | 0.84 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FAAHAKR1B1 | |
| SCHEMBL6437224 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013167585-A2 | RECYCLING OF ORGANOTIN COMPOUNDS | UNIVERSITEIT ANTWERPEN (BE) | 2013-11-14 | — | — | WO | claimed |
| WO-2013167585-A2 | RECYCLING OF ORGANOTIN COMPOUNDS | UNIVERSITEIT ANTWERPEN (BE) | 2013-11-14 | — | — | WO | disclosed |