Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | RARA | P10276 | 5/20 | 0.48 |
| ▸ | RARB | P10826 | 5/20 | 0.48 |
| ▸ | RARG | P13631 | 5/20 | 0.48 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.42 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30353220 | 0.86 | RARA (0.54) | RARARARBRARGRXRACYP26A1 | |
| SCHEMBL28347731 | 0.86 | RARA (0.54) | RARARARBRARGRXRACYP26A1 | |
| SCHEMBL2240683 | 0.84 | RARB (0.64) | KDM4ERARARARBRARGRXRA | |
| SCHEMBL29696137 | 0.84 | CYP26A1 (0.47) | KDM4ERARARARBRARGRXRA | |
| SCHEMBL30134236 | 0.83 | KDM4E (0.53) | KDM4ERARARARBRARGRXRA | |
| SCHEMBL30353267 | 0.81 | NPC1 (0.58) | RARARARBRARGRXRANPC1 | |
| SCHEMBL4421853 | 0.81 | KDM4E (0.50) | KDM4ERARARARBRARGRXRA | |
| SCHEMBL29655815 | 0.80 | SMN1; SMN2 (0.47) | RARARARBRARGCYP26A1CYP26B1 | |
| SCHEMBL29655774 | 0.77 | NPC1 (0.56) | NPC1RAB9AHPGD | |
| SCHEMBL7681598 | 0.76 | KDM4E (0.46) | KDM4ERARARARBRARGRXRA |
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-111039916-B | Tricyclic spiro compounds | 小野药品工业株式会社 | 2023-04-28 | — | — | CN | disclosed |