Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20095509 | 0.90 | HTR2C (0.33) | SIGMAR1 | |
| SCHEMBL20095495 | 0.82 | HTR2C (0.39) | — | |
| SCHEMBL20095906 | 0.81 | HTR2C (0.44) | — | |
| SCHEMBL20095502 | 0.80 | DRD2 (0.42) | — | |
| SCHEMBL20095503 | 0.78 | SCN9A (0.43) | — | |
| SCHEMBL20063902 | 0.73 | AKR1C3 (0.46) | AKR1C3AKR1C1SIGMAR1KDM4ELMNA | |
| SCHEMBL20095803 | 0.70 | SIGMAR1 (0.34) | SIGMAR1 | |
| SCHEMBL20095806 | 0.70 | KDM1A (0.36) | MAP1LC3B | |
| SCHEMBL20095793 | 0.70 | KDM1A (0.36) | MAP1LC3B | |
| SCHEMBL3144036 | 0.69 | MAOB (0.43) | LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018072602-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2018-04-26 | — | — | WO | disclosed |