Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | IAPP | P10997 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27773602 | 0.81 | TRPA1 (0.48) | TRPA1ATMIAPPCA1CA2 | |
| SCHEMBL16958862 | 0.78 | TRPA1 (0.39) | TRPA1ATMCA1CA2MAPT | |
| SCHEMBL7949288 | 0.78 | TRPA1 (0.58) | TRPA1CA1CA2NFKB1CA4 | |
| SCHEMBL27590087 | 0.76 | TRPA1 (0.68) | TRPA1ATMCA1CA2NFKB1 | |
| SCHEMBL27517811 | 0.76 | TRPA1 (0.43) | TRPA1ATMIAPPCA1CA2 | |
| SCHEMBL7855649 | 0.76 | CDK4 (0.66) | TRPA1ATMIAPPCA1CA2 | |
| SCHEMBL17266679 | 0.76 | TRPA1 (0.43) | TRPA1ATMIAPPCA1CA2 | |
| SCHEMBL26746374 | 0.76 | TRPA1 (0.68) | TRPA1ATMCA1CA2NFKB1 | |
| SCHEMBL10589353 | 0.76 | NFKB1 (0.69) | TRPA1ATMIAPPCA1CA2 | |
| SCHEMBL14049586 | 0.76 | TRPA1 (0.43) | TRPA1ATMIAPPCA1CA2 |
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-104619682-A | Polyisocyanate composition and isocyanate polymer composition | ASAHI KASEI CHEMICALS CORP | 2015-05-13 | — | — | CN | disclosed |