Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9026497 | 1.00 | ESR1 (0.46) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9025659 | 0.90 | ESR1 (0.43) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9025666 | 0.90 | ESR1 (0.43) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9026525 | 0.85 | ESR1 (0.41) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9026527 | 0.85 | ESR1 (0.41) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9026328 | 0.85 | CACNA1C (0.40) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9026019 | 0.84 | ESR1 (0.40) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9026012 | 0.84 | ESR1 (0.40) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9025620 | 0.79 | CACNA1C (0.42) | ESR1PTGS1PDE4AABCC2CACNA1C | |
| SCHEMBL9025623 | 0.79 | CACNA1C (0.42) | ESR1PTGS1PDE4AABCC2CACNA1C |
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-0704446-A1 | NOVEL BETA-LACTAM COMPOUND AND PROCESS FOR PRODUCING THE SAME | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1996-04-03 | — | — | EP | disclosed |