Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL564456 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| SCHEMBL28256353 | 0.73 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| Hydrochloric Acid SCHEMBL31362231 | 0.73 | ALDH1A1 (0.54) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| SCHEMBL4649848 | 0.73 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| SCHEMBL28423034 | 0.72 | KDM4E (0.47) | ALDH1A1KDM4ETDP1TSHRDNM1 | |
| Bromide SCHEMBL5127809 | 0.72 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| Bromide SCHEMBL11060577 | 0.72 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1TSHRTAAR1 | |
| SCHEMBL27528800 | 0.71 | MAPT (0.40) | ALDH1A1KDM4ETDP1TSHRHTR6 | |
| SCHEMBL28021011 | 0.70 | ACHE (0.57) | ALDH1A1KDM4ETDP1MEN1KMT2A | |
| SCHEMBL2006876 | 0.70 | MAPT (0.39) | ALDH1A1KDM4ETDP1TSHRHTR6 |
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-1200426-B1 | SUBSTITUTED THIENE-3-YL-SULFONYL AMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES | BAYER CROPSCIENCE AG (DE) | 2004-02-25 | — | — | EP | disclosed |