Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.52 |
| ▸ | FEN1 | P39748 | 1/20 | 0.52 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | HEXA | P06865 | 4/20 | 0.45 |
| ▸ | HEXB | P07686 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28346128 | 0.83 | EHMT2 (0.50) | ALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL9550468 | 0.76 | ERCC1 (0.57) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL10262751 | 0.71 | CYP1B1 (0.71) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL27752410 | 0.70 | ERCC1 (0.65) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL24453236 | 0.69 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL862546 | 0.69 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL21099252 | 0.69 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL6734026 | 0.69 | ERCC1 (0.63) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL4604913 | 0.69 | MPO (0.70) | ERCC1FEN1ERCC4ALDH1A1KDM4E | |
| SCHEMBL29410043 | 0.69 | ERCC1 (1.00) | ERCC1FEN1ERCC4ALDH1A1KDM4E |
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-115197114-B | Aromatic selenocyanum compound and green synthesis method and application thereof | 南宁师范大学 | 2023-09-05 | — | — | CN | disclosed |
| CN-115197114-A | Aromatic selenium cyanogen ester compound and green synthesis method and application thereof | 南宁师范大学 | 2022-10-18 | — | — | CN | disclosed |