Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 2/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | MOK | Q9UQ07 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27917367 | 0.80 | DHODH (0.58) | DHODHLMNAADORA3ADORA1MOK | |
| SCHEMBL9988793 | 0.76 | DHODH (0.53) | DHODHLMNAADORA3ADORA1MOK | |
| SCHEMBL20414372 | 0.75 | DHODH (0.52) | DHODHLMNAMOKKDM4EALDH1A1 | |
| SCHEMBL28118267 | 0.75 | KDM4E (0.43) | DHODHLMNAPDE10APARP1KDM4E | |
| SCHEMBL7720171 | 0.73 | ATM (0.49) | CYP1A2LMNAPDE10APARP1KDM4E | |
| Quinoline SCHEMBL28796283 | 0.72 | DHODH (0.45) | DHODHSYKTOP1NPC1ADORA3 | |
| SCHEMBL31026572 | 0.71 | CCR1 (0.54) | LMNANPC1KDM4EALDH1A1MAPT | |
| SCHEMBL669488 | 0.70 | LMNA (0.61) | SYKTOP1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL20903641 | 0.70 | CCR1 (0.46) | DHODHSYKTOP1CYP1A2CYP1B1 | |
| SCHEMBL6115223 | 0.70 | CYP19A1 (0.51) | CYP19A1LMNAKDM4EALDH1A1MAPT |
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-104159947-B | polymer and organic electroluminescent element | 三菱化学株式会社 | 2016-10-05 | — | — | CN | disclosed |