Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ERN1 | O75460 | 8/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.44 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.44 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.44 |
| ▸ | ABAT | P80404 | 1/20 | 0.44 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30865006 | 0.93 | ALDH1A1 (0.62) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL24663368 | 0.90 | ALDH1A1 (0.57) | ALDH1A1TSHRTDP1HPGDAOX1 | |
| SCHEMBL9717769 | 0.83 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL30865007 | 0.80 | ALDH1A1 (0.75) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL6224414 | 0.77 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL3136850 | 0.76 | ALDH1A1 (0.90) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL26628327 | 0.75 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL12740233 | 0.75 | ERN1 (0.58) | ALDH1A1TSHRTDP1ERN1HPGD | |
| SCHEMBL2002821 | 0.74 | ERN1 (0.59) | ALDH1A1TSHRTDP1ERN1HPGD | |
| SCHEMBL12459049 | 0.74 | ALDH1A1 (0.51) | ALDH1A1TSHRTDP1KDM4EERN1 |
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-117624520-A | Trifluoromethyl modified pyrenyl covalent organic framework material, and preparation method and application thereof | 中国石油大学(华东) | 2024-03-01 | — | — | CN | claimed |
| CN-117624520-A | Trifluoromethyl modified pyrenyl covalent organic framework material, and preparation method and application thereof | 中国石油大学(华东) | 2024-03-01 | — | — | CN | disclosed |