Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 2/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 4/20 | 0.52 |
| ▸ | CA1 | P00915 | 4/20 | 0.52 |
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | CA7 | P43166 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.47 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.47 |
| ▸ | GABRP | O00591 | 1/20 | 0.46 |
| ▸ | GABRD | O14764 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29213184 | 0.93 | CA12 (0.55) | ACP1RIPK1CA12CA1CA2 | |
| SCHEMBL29213230 | 0.86 | NPC1 (0.52) | ACP1RIPK1CA12CA1CA2 | |
| SCHEMBL29213187 | 0.82 | MAPT (0.54) | ACP1MAPTALDH1A1GABRPGABRD | |
| SCHEMBL29213208 | 0.78 | CA12 (0.56) | ACP1RIPK1CA12CA1CA2 | |
| SCHEMBL29213225 | 0.78 | POLB (0.49) | MAPTALDH1A1ERCC1ERCC4GABRP | |
| SCHEMBL29213179 | 0.75 | MAPT (0.56) | ACP1MAPTALDH1A1KMT2AMAOB | |
| SCHEMBL11215787 | 0.73 | RIPK1 (0.73) | ACP1RIPK1MAPTALDH1A1KMT2A | |
| SCHEMBL21642925 | 0.72 | ACP1 (0.74) | ACP1RIPK1MAPTALDH1A1KMT2A | |
| SCHEMBL11063315 | 0.72 | RIPK1 (0.78) | ACP1RIPK1MAPTALDH1A1KMT2A | |
| SCHEMBL30526521 | 0.71 | RIPK1 (0.71) | ACP1RIPK1MAPTALDH1A1KMT2A |
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-117843579-A | Benzo heterocycle coupled catechol derivative and preparation method and application thereof | 暨南大学 | 2024-04-09 | — | — | CN | disclosed |