Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 9/20 | 0.64 |
| ▸ | MAOA | P21397 | 5/20 | 0.58 |
| ▸ | MAOB | P27338 | 4/20 | 0.58 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP9 | P55211 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6535436 | 0.88 | CASP3 (0.67) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL7566978 | 0.81 | CASP3 (0.74) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL6949029 | 0.80 | PKLR (0.42) | CASP3MAOAMAOBNAMPTGAA | |
| SCHEMBL6535335 | 0.78 | CASP3 (1.00) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL7486332 | 0.77 | CASP3 (0.68) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL4906814 | 0.76 | MAOA (0.78) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL4411083 | 0.75 | CASP3 (0.64) | CASP3MAOAMAOBCA12CA1 | |
| SCHEMBL14111824 | 0.73 | SMN1; SMN2 (0.57) | PDE3BPDE3ACA12CA1CA2 | |
| SCHEMBL2333739 | 0.73 | TDP1 (0.60) | CA12CA1CA2CA9NAMPT | |
| SCHEMBL11174132 | 0.73 | TDP1 (0.51) | NAMPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6403792-B1 | INHIBIT PRODUCTION OF CASPASE 3 AND 7 IN MAMMALS | SMITHKLINE BEECHAM CORPORATION | 2002-06-11 | — | — | US | claimed |
| US-6403792-B1 | INHIBIT PRODUCTION OF CASPASE 3 AND 7 IN MAMMALS | SMITHKLINE BEECHAM CORPORATION | 2002-06-11 | — | — | US | disclosed |