Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 11/20 | 0.49 |
| ▸ | CASP7 | P55210 | 4/20 | 0.49 |
| ▸ | CASP9 | P55211 | 2/20 | 0.49 |
| ▸ | CASP1 | P29466 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28806856 | 0.81 | CASP3 (0.42) | CASP3CASP7CASP9CASP1CA12 | |
| SCHEMBL27605812 | 0.81 | PARG (0.40) | — | |
| SCHEMBL27913253 | 0.78 | CASP3 (0.41) | CASP3CASP7CASP9CASP1 | |
| SCHEMBL27951598 | 0.76 | CHRM2 (0.36) | — | |
| SCHEMBL5988598 | 0.75 | CASP3 (0.79) | CASP3CASP7CASP9CASP1CA12 | |
| SCHEMBL27593507 | 0.74 | CHRM2 (0.39) | CASP7CASP1CA12CA1CA2 | |
| SCHEMBL27593641 | 0.74 | ALDH1A1 (0.39) | CA12CA1CA2CA9 | |
| SCHEMBL27889639 | 0.74 | GAA (0.59) | — | |
| SCHEMBL27788104 | 0.73 | CHRM2 (0.50) | — | |
| SCHEMBL28813536 | 0.73 | ALDH1A1 (0.36) | CA12CA1CA2CA9 |
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-103183631-A | Novel isatin-5-sulfonamide derivative and application of same in preparation of medicines used for treating atypical pneumonia | TIANJIN INT JOINT ACADEMY BIOTECHNOLOGY & MEDICINE | 2013-07-03 | — | — | CN | disclosed |