Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.59 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.59 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.37 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.37 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.37 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.37 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.37 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.37 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10614563 | 1.00 | NFE2L2 (0.59) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| Hydrogen Sulfide SCHEMBL28231457 | 0.98 | NFE2L2 (0.58) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| Water SCHEMBL28632016 | 0.80 | NFE2L2 (0.68) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL29032542 | 0.79 | NFE2L2 (0.39) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL1654495 | 0.78 | NFE2L2 (0.70) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL1654497 | 0.78 | NFE2L2 (0.70) | NFE2L2TRPA1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL6536304 | 0.77 | HTT (0.61) | NFE2L2 | |
| SCHEMBL9218104 | 0.75 | KDM4E (0.42) | NFE2L2TRPA1 | |
| SCHEMBL9250953 | 0.75 | CYP11B1 (0.40) | NFE2L2TRPA1 | |
| SCHEMBL23744199 | 0.75 | ALDH1A1 (0.40) | CYP1A2 |
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-4762900-A | FROM EPOXIDE AND ISOCYANATE | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1988-08-09 | — | — | US | disclosed |