Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.53 |
| ▸ | APEX1 | P27695 | 1/20 | 0.53 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Aminomethylbenzoic Acid SCHEMBL11755138 | 0.93 | ALDH1A1 (0.61) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL9344424 | 0.93 | ALDH1A1 (0.60) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL38758 | 0.93 | ALDH1A1 (0.60) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL28342619 | 0.91 | ALDH1A1 (0.58) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL1206230 | 0.91 | ALDH1A1 (0.58) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL1567841 | 0.91 | ALDH1A1 (0.58) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL7428232 | 0.91 | ALDH1A1 (0.58) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| Aminomethylbenzoic Acid SCHEMBL7772038 | 0.88 | ALDH1A1 (0.52) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| SCHEMBL1851387 | 0.87 | HRH3 (0.61) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 | |
| SCHEMBL26112100 | 0.87 | SRD5A2 (0.58) | ALDH1A1LOXL2HDAC3HDAC6NCOR2 |
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-114890947-B | Aromatic heterocyclic compound containing quinoline structural unit, and preparation method and application thereof | 郑州大学 | 2024-07-16 | — | — | CN | disclosed |