Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8440478 | 0.80 | ALDH1A1 (0.41) | SMN1; SMN2HTTALDH1A1HSP90AA1POLB | |
| SCHEMBL8442899 | 0.77 | FDFT1 (0.41) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL8300407 | 0.66 | ALDH1A1 (0.42) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL481332 | 0.65 | CA1 (0.61) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL128190 | 0.64 | CA1 (0.70) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| Benzene SCHEMBL27873122 | 0.64 | CA1 (0.76) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL87450 | 0.64 | CA1 (0.83) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| Hydrochloric Acid SCHEMBL10669311 | 0.63 | SMN1; SMN2 (0.59) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL245250 | 0.63 | CA1 (0.63) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 | |
| SCHEMBL1995591 | 0.62 | CA1 (0.68) | SMN1; SMN2HTTALDH1A1HPGDHSP90AA1 |
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-0915843-A1 | AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSES | SMITHKLINE BEECHAM PLC (GB) | 1999-05-19 | — | — | EP | disclosed |
| WO-1997041098-A1 | AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS | SMITHKLINE BEECHAM PLC (GB) | 1997-11-06 | — | — | WO | disclosed |