Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | MYC | P01106 | 2/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8387656 | 0.85 | ALDH1A1 (0.44) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL17396421 | 0.81 | HAAO (0.40) | ALDH1A1TSHRTDP1MYCCSNK2A1 | |
| SCHEMBL598479 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8391857 | 0.80 | ALDH1A1 (0.40) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8492600 | 0.79 | TSHR (0.47) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL27544752 | 0.78 | CSNK2A2 (0.49) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL17395308 | 0.78 | GPR35 (0.40) | ALDH1A1TSHRSMN1; SMN2MYCNR4A1 | |
| SCHEMBL17593679 | 0.78 | KDM4E (0.43) | ALDH1A1CASP1TDP1CSNK2A1MAPT | |
| SCHEMBL8387276 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8389398 | 0.76 | SORT1 (0.42) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 |
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 |