Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | FBP1 | P09467 | 1/20 | 0.33 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.32 |
| ▸ | PTGFR | P43088 | 1/20 | 0.32 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.32 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.32 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8791943 | 0.84 | HPGD (0.42) | HPGDMAPTCYP2C19FBP1PTGER1 | |
| SCHEMBL9738451 | 0.82 | HPGD (0.37) | HPGDMAPTKDM4EHSD17B10CYP2C19 | |
| SCHEMBL3924427 | 0.78 | GAA (0.38) | HPGDMAPTKDM4EHSD17B10CYP2C19 | |
| SCHEMBL8794253 | 0.77 | MAPT (0.37) | HPGDMAPTKDM4EHSD17B10PTGER1 | |
| SCHEMBL3928912 | 0.76 | GAA (0.42) | HPGDMAPTKDM4EHSD17B10CYP2C19 | |
| SCHEMBL12315835 | 0.73 | HPGD (0.41) | HPGDMAPTCYP2C19FBP1PTGER1 | |
| SCHEMBL8793076 | 0.72 | CYP2C19 (0.42) | HPGDMAPTKDM4ECYP2C19FBP1 | |
| SCHEMBL4323474 | 0.72 | HPGD (0.44) | HPGDMAPTCYP2C19FBP1PTGER1 | |
| SCHEMBL4328403 | 0.72 | HPGD (0.44) | HPGDMAPTCYP2C19FBP1PTGER1 | |
| SCHEMBL4323776 | 0.72 | HPGD (0.44) | HPGDMAPTCYP2C19FBP1PTGER1 |
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-0453195-A1 | (S)-alkyl 3-(thien-2-ylthio) butyrate and analogs and synthesis thereof | MERCK & CO. INC. (US) | 1991-10-23 | — | — | EP | disclosed |