Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25911510 | 0.91 | TSHR (0.71) | TSHRCYP1A2PTGS1PTGS2NFE2L2 | |
| SCHEMBL29349761 | 0.91 | CYP1A2 (0.59) | TSHRCYP1A2NPC1MAPTRAB9A | |
| SCHEMBL372652 | 0.83 | NFE2L2 (0.59) | PTGS1PTGS2NFE2L2NPC1MAPT | |
| SCHEMBL19523658 | 0.83 | NFE2L2 (0.43) | TSHRCYP1A2PTGS1PTGS2NFE2L2 | |
| SCHEMBL1292955 | 0.83 | NFE2L2 (0.59) | PTGS1PTGS2NFE2L2NPC1MAPT | |
| SCHEMBL7512833 | 0.83 | MAOB (0.61) | TSHRCYP1A2NFE2L2NPC1MAPT | |
| SCHEMBL7592145 | 0.83 | MAOB (0.61) | TSHRCYP1A2NFE2L2NPC1MAPT | |
| SCHEMBL10538593 | 0.81 | RELA (0.51) | TSHRCYP1A2PTGS1PTGS2NFE2L2 | |
| SCHEMBL23458017 | 0.81 | NFE2L2 (0.56) | PTGS1PTGS2NFE2L2NPC1MAPT | |
| SCHEMBL1825729 | 0.81 | CYP1A2 (0.64) | TSHRCYP1A2PTGS1PTGS2NPC1 |
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-4880874-A | MOLDING MATERIALS | SUMITOMO NAUGATUCK CO., LTD. (JP) | 1989-11-14 | — | — | US | disclosed |