Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 4/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14720844 | 0.82 | CA1 (0.42) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL28780184 | 0.81 | KMT2A (0.44) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL5194718 | 0.75 | CA1 (0.48) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL6908002 | 0.74 | CA1 (0.45) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL29034970 | 0.74 | CA1 (0.35) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL6908639 | 0.71 | CA1 (0.45) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL13858657 | 0.70 | — | — | |
| SCHEMBL11861011 | 0.69 | KMT2A (0.47) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL11854691 | 0.69 | KMT2A (0.47) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL11852548 | 0.69 | KMT2A (0.47) | CA1CA2CA4KMT2AALDH1A1 |
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-113544120-B | Novel compound, composition containing same, self-repairing material, surface coating agent, paint, adhesive, battery material, and cured product | 株式会社ADEKA | 2023-05-02 | — | — | CN | disclosed |