Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.56 |
| ▸ | CASP6 | P55212 | 2/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.41 |
| ▸ | NT5E | P21589 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | TIMP3 | P35625 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| 4-Chloroaniline SCHEMBL11067039 | 0.95 | APEX1 (0.54) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11059267 | 0.95 | APEX1 (0.54) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11044460 | 0.94 | APEX1 (0.53) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL9145883 | 0.93 | APEX1 (0.64) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11057878 | 0.92 | APEX1 (0.55) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11049881 | 0.91 | APEX1 (0.57) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11050005 | 0.90 | APEX1 (0.53) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11053238 | 0.88 | APEX1 (0.51) | APEX1CASP6CTDSP1ENPP2NT5E | |
| Anthranilic Acid SCHEMBL11074466 | 0.86 | APEX1 (0.58) | APEX1CASP6CTDSP1ENPP2NT5E | |
| SCHEMBL11084677 | 0.86 | APEX1 (0.51) | APEX1CASP6CTDSP1ENPP2NT5E |
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 |
|---|---|---|---|---|---|---|---|
| US-4473498-A | Water-soluble, fiber-reactive organic dyestuffs containing a β-chloro-ethylsulfonyl-methyl-benzoic acid amide group | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-09-25 | — | — | US | disclosed |