Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 4/20 | 0.41 |
| ▸ | NQO2 | P16083 | 4/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.37 |
| ▸ | MMP9 | P14780 | 3/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.37 |
| ▸ | IAPP | P10997 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RGS12 | O14924 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29815216 | 0.89 | KDM1A (0.38) | NQO2NR1H3MMP2MMP9PTGS1 | |
| SCHEMBL29815053 | 0.87 | NFE2L2 (0.48) | RELAMMP9PTGS1ALOX12KDM4E | |
| SCHEMBL29815013 | 0.86 | APP (0.35) | RELAMMP2MMP9MMP1MAPT | |
| SCHEMBL28820816 | 0.83 | BCHE (0.39) | KDM4EMAPTLMNAPOLB | |
| SCHEMBL28820660 | 0.83 | BCHE (0.39) | KDM4EMAPTLMNAPOLB | |
| SCHEMBL29815022 | 0.81 | CYP19A1 (0.41) | NQO2RELAMAPTKMT2AMEN1 | |
| SCHEMBL29815035 | 0.81 | NFE2L2 (0.41) | PTGS1KDM4EMAPTKMT2ATP53 | |
| SCHEMBL29814949 | 0.81 | ERBB2 (0.37) | KDM4ENPC1ALDH1A1LMNAHPGD | |
| SCHEMBL29815123 | 0.81 | TRPA1 (0.41) | LCKPTGS1ALDH1A1TTRALOX5 | |
| SCHEMBL31231848 | 0.78 | APP (0.40) | SMN1; SMN2 |
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-110308124-B | Application of fluorescence probe containing benzothiazole compound in detecting bacterial messenger molecule c-di-GMP | 暨南大学 | 2022-06-03 | — | — | CN | disclosed |