Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7582102 | 0.85 | GRM1 (0.36) | TSHRGRM1ATM | |
| SCHEMBL8388430 | 0.79 | MAPT (0.33) | ALDH1A1MAPTHPGD | |
| Cyclopropane SCHEMBL8727309 | 0.77 | ALDH1A1 (0.32) | ALDH1A1MAPTHPGD | |
| SCHEMBL8488251 | 0.75 | SLC6A4 (0.35) | TSHRALDH1A1MAPTATMKDM4E | |
| SCHEMBL8488252 | 0.75 | SLC6A4 (0.35) | TSHRALDH1A1MAPTATMKDM4E | |
| SCHEMBL8391671 | 0.75 | — | — | |
| SCHEMBL8725799 | 0.75 | MAPT (0.32) | ALDH1A1MAPTHPGD | |
| SCHEMBL9236388 | 0.75 | KMT2A (0.47) | TSHRALDH1A1MAPTHPGDATM | |
| SCHEMBL9236386 | 0.75 | KMT2A (0.47) | TSHRALDH1A1MAPTHPGDATM | |
| SCHEMBL9239220 | 0.75 | TAS1R3 (0.44) | ATMKDM4EKMT2ARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0625508-B1 | Sulfur-containing derivatives of 2-cyano-1,3-diones and their use as herbicides | RHONE POULENC AGRICULTURE (GB) | 1998-08-19 | — | — | EP | disclosed |
| EP-0625508-A2 | Sulfur-containing derivatives of 2-cyano-1,3-diones and their use as herbicides | RHONE POULENC AGRICULTURE LTD. (GB) | 1994-11-23 | — | — | EP | disclosed |