Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 8/20 | 0.41 |
| ▸ | CTSS | P25774 | 4/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 4/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30096643 | 1.00 | ATM (0.43) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL31028245 | 1.00 | ATM (0.43) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL31362545 | 0.96 | ATM (0.42) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL30096601 | 0.93 | ATM (0.45) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL28523692 | 0.93 | ATM (0.45) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL31362303 | 0.89 | ATM (0.42) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL31028265 | 0.89 | PPARA (0.42) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL31362373 | 0.88 | PPARA (0.41) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL28522143 | 0.87 | CTSK (0.41) | ATMCTSKCTSSCTSLCTSB | |
| SCHEMBL28821392 | 0.86 | ALDH1A1 (0.40) | ATMCTSKCTSSCTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| CN-112351778-B | Fused tricyclic heterocycles and therapeutic uses thereof | 江苏恒瑞医药股份有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-112351778-A | Fused tricyclic heterocycles and therapeutic uses thereof | 江苏恒瑞医药股份有限公司 | 2021-02-09 | — | — | CN | disclosed |