Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 5/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | NFATC1 | O95644 | 2/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28823336 | 0.86 | SLC22A12 (0.38) | SLC22A12PTGS2PTGS1PIK3CDPIK3CA | |
| SCHEMBL28038639 | 0.76 | CYP2A6 (0.42) | SLC22A12PTGS2PTGS1PIK3CDMAOA | |
| SCHEMBL28038268 | 0.72 | PTGS2 (0.50) | SLC22A12PTGS2PTGS1GSK3BDYRK1A | |
| SCHEMBL28448365 | 0.69 | SLC22A12 (0.76) | SLC22A12PTGS2PTGS1PIK3CDPIK3CA | |
| SCHEMBL1271423 | 0.69 | SLC22A12 (0.41) | SLC22A12PTGS2PTGS1NFATC1GSK3B | |
| SCHEMBL14686325 | 0.69 | NPC1 (0.48) | — | |
| SCHEMBL14686293 | 0.68 | PTGS1 (0.34) | PTGS2PTGS1CYP17A1 | |
| SCHEMBL14686341 | 0.68 | NFE2L2 (0.46) | SLC22A12PTGS2PTGS1CYP17A1ERN1 | |
| SCHEMBL1272675 | 0.67 | LATS1 (0.41) | SLC22A12PTGS2PTGS1NFATC1GSK3B | |
| SCHEMBL11379135 | 0.67 | SLC22A12 (0.46) | SLC22A12CCNCCDK8ERN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101180266-B | As the alpha ketoamide compounds of cystatin | Vero Bay (US) | 2015-11-25 | — | — | CN | disclosed |