Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PTPN5 | P54829 | 3/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL27323950 | 0.81 | ALDH1A1 (0.53) | KIF11ALDH1A1PTPN5PTPN1TAAR1 | |
| Biphenyl SCHEMBL27485574 | 0.81 | ALDH1A1 (0.60) | KIF11ALDH1A1PTPN5PTPN1TAAR1 | |
| Toluene SCHEMBL8139791 | 0.78 | LMNA (0.52) | KIF11ALDH1A1TSHRLMNAHTT | |
| Biphenyl SCHEMBL8089799 | 0.75 | KIF11 (0.46) | KIF11ALDH1A1PTPN5PTPN1TAAR1 | |
| Biphenyl SCHEMBL23430128 | 0.74 | ALDH1A1 (0.69) | KIF11ALDH1A1TAAR1MMP3BCL2L1 | |
| Benzene SCHEMBL26127054 | 0.73 | CES1 (0.36) | — | |
| Biphenyl SCHEMBL27620162 | 0.72 | KIF11 (0.48) | KIF11ALDH1A1PTPN5PTPN1TAAR1 | |
| Trifluoroacetic Acid SCHEMBL12611414 | 0.72 | CES1 (0.52) | KIF11ALDH1A1PTPN5PTPN1CYP2C9 | |
| Biphenyl SCHEMBL27543247 | 0.72 | ALDH1A1 (0.64) | KIF11ALDH1A1PTPN5PTPN1TAAR1 | |
| Benzene SCHEMBL6754211 | 0.71 | ALDH1A1 (0.90) | ALDH1A1TAAR1MMP3BCL2L1MGLL |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001169798-A | METHOD FOR PRODUCING BOTH ENANTIOMERS OF OPTICALLY ACTIVE AZULENE TRIFLUOROETHANOL DERIVATIVE BY USE OF LIPASE | KONAN KAKO KK | 2001-06-26 | — | — | JP | disclosed |