Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LDHA | P00338 | 2/20 | 0.38 |
| ▸ | LDHB | P07195 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | USP8 | P40818 | 1/20 | 0.31 |
| ▸ | USP5 | P45974 | 1/20 | 0.31 |
| ▸ | USP4 | Q13107 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7936881 | 0.79 | TRPA1 (0.38) | ALDH1A1TRPA1ATMPOLBTSHR | |
| SCHEMBL9078886 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TRPA1KDM4EHPGDHSD17B10 | |
| SCHEMBL231786 | 0.79 | TSHR (0.44) | ALDH1A1KDM4EHSD17B10POLBTSHR | |
| SCHEMBL6285174 | 0.76 | ALDH1A1 (0.62) | ALDH1A1TRPA1GABRA1GABRB2KDM4E | |
| SCHEMBL31684003 | 0.76 | ALDH1A1 (0.62) | ALDH1A1TRPA1GABRA1GABRB2KDM4E | |
| SCHEMBL15083368 | 0.76 | ALDH1A1 (0.62) | ALDH1A1TRPA1GABRA1GABRB2KDM4E | |
| SCHEMBL21495996 | 0.76 | ALDH1A1 (0.40) | ALDH1A1POLBTSHRCYP3A4AR | |
| SCHEMBL27491094 | 0.75 | ALDH1A1 (0.78) | ALDH1A1TRPA1GABRA1GABRB2KDM4E | |
| SCHEMBL28278985 | 0.74 | ALDH1A1 (0.59) | ALDH1A1TRPA1GABRA1GABRB2KDM4E | |
| Cyanate SCHEMBL27968920 | 0.73 | ALDH1A1 (0.74) | ALDH1A1TRPA1GABRA1GABRB2KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4145006-A | — | — | None | — | — | JP | disclosed |
| JP-H04145006-A | INSECT-PROOFING AGENT COMPOSED MAINLY OF AROMATIC THIOCYANIC ACID COMPOUND AND SUITABLE FOR CORRUGATED FIBERBOARD, PAPER AND PAPER PRODUCT | RENGO CO LTD | 1992-05-19 | — | — | JP | disclosed |