Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28276621 | 0.81 | TSHR (0.42) | ALDH1A1 | |
| N,N-Dimethylethanaminium SCHEMBL27917815 | 0.80 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL6666590 | 0.79 | ALDH1A1 (0.33) | ALDH1A1 | |
| Isopropylamine SCHEMBL4924220 | 0.79 | PLA2G1B (0.39) | ALDH1A1PLA2G1BPLA2G2A | |
| Ethylamine SCHEMBL6014208 | 0.78 | PLA2G1B (0.31) | ALDH1A1PLA2G1BPLA2G2A | |
| Isobutane SCHEMBL28239716 | 0.78 | CHRM2 (0.36) | ALDH1A1PLA2G1BPLA2G2A | |
| Ethylamine SCHEMBL20162310 | 0.78 | — | — | |
| SCHEMBL1875382 | 0.78 | ALDH1A1 (0.58) | ALDH1A1 | |
| SCHEMBL16339 | 0.78 | — | — | |
| Ethylenediamine SCHEMBL10573240 | 0.74 | DNM1 (0.32) | ALDH1A1 |
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-117282256-A | Aqueous mixed amine liquid-liquid phase absorbent for capturing carbon dioxide | 四川大学 | 2023-12-26 | — | — | CN | disclosed |