Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8495104 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KDM4EPOLBSMN1; SMN2NPSR1 | |
| SCHEMBL8721455 | 0.76 | ALDH1A1 (0.38) | ALDH1A1LMNACYP2C19TSHRCYP3A4 | |
| SCHEMBL8490640 | 0.73 | PPARG (0.38) | ALDH1A1KDM4EPOLBLMNASMN1; SMN2 | |
| SCHEMBL8494889 | 0.72 | SRD5A2 (0.46) | ALDH1A1SMN1; SMN2HPGDPPARGPPARA | |
| SCHEMBL8899320 | 0.69 | ALDH1A1 (0.42) | ALDH1A1KDM4EPOLBSMN1; SMN2NPSR1 | |
| SCHEMBL8494224 | 0.68 | PPARG (0.35) | ALDH1A1KDM4EPOLBLMNACYP2C19 | |
| SCHEMBL8491021 | 0.67 | CYP2C9 (0.54) | ALDH1A1KDM4ELMNACYP2C19SMN1; SMN2 | |
| SCHEMBL7995488 | 0.66 | SMN1; SMN2 (0.47) | ALDH1A1POLBLMNACYP2C19TSHR | |
| SCHEMBL11033155 | 0.66 | ALDH1A1 (0.46) | ALDH1A1KDM4EPOLBLMNASMN1; SMN2 | |
| SCHEMBL11033152 | 0.66 | ALDH1A1 (0.46) | ALDH1A1KDM4EPOLBLMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0766666-B1 | BENZYLSULFIDE DERIVATIVE, PROCESS FOR ITS PRODUCTION AND PESTICIDE | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1999-03-17 | — | — | EP | disclosed |