Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | HCAR3 | P49019 | 13/20 | 0.54 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL18653913 | 0.87 | CASP6 (0.64) | CASP6TSHRLMNAHCAR3APEX1 | |
| SCHEMBL14934235 | 0.85 | PARP1 (0.59) | CASP6TSHRLMNA | |
| SCHEMBL288907 | 0.83 | CASP6 (0.64) | CASP6TSHRLMNAHCAR3APEX1 | |
| SCHEMBL28432435 | 0.82 | CASP6 (0.62) | CASP6TSHRLMNAHCAR3APEX1 | |
| SCHEMBL15209795 | 0.81 | HCAR3 (0.46) | CASP6TSHRHCAR3 | |
| SCHEMBL15208678 | 0.81 | VCAM1 (0.58) | LMNA | |
| SCHEMBL15209431 | 0.81 | ALDH1A1 (0.52) | CASP6TSHRLMNAHCAR3 | |
| SCHEMBL15208534 | 0.81 | HCAR3 (0.51) | TSHRLMNAHCAR3 | |
| SCHEMBL23037538 | 0.81 | CASP6 (0.60) | CASP6TSHRLMNAHCAR3APEX1 | |
| SCHEMBL14934213 | 0.79 | PARP1 (0.42) | CASP6TSHRLMNA |
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-106810512-B | IDH2 mutant inhibitor and application thereof | 江苏省中医药研究院 | 2019-09-10 | — | — | CN | disclosed |