Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30945799 | 0.89 | TSHR (0.44) | TDP1HSD17B10LMNATSHRCHRM2 | |
| SCHEMBL28762370 | 0.83 | TSHR (0.50) | TDP1HSD17B10LMNATSHRCHRM2 | |
| SCHEMBL22442289 | 0.83 | TDP1 (0.53) | TDP1HSD17B10LMNAMAPTHTT | |
| SCHEMBL16244181 | 0.83 | TSHR (0.50) | TDP1HSD17B10LMNATSHRCHRM2 | |
| SCHEMBL105187 | 0.82 | TDP1 (0.52) | TDP1HSD17B10TSHRCHRM2CHRM4 | |
| SCHEMBL17905231 | 0.81 | TDP1 (0.47) | TDP1HSD17B10MAPTHTTCYP3A4 | |
| SCHEMBL1128518 | 0.80 | TDP1 (0.50) | TDP1HSD17B10MAPTHTTCYP3A4 | |
| SCHEMBL445697 | 0.80 | TDP1 (0.50) | TDP1HSD17B10LMNAMAPTHTT | |
| Methyl Alcohol SCHEMBL15345249 | 0.80 | TDP1 (0.50) | TDP1HSD17B10TSHRCHRM2CHRM4 | |
| SCHEMBL5574519 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4446310-A1 | METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND | Asahi Kasei Kabushiki Kaisha (JP) | 2024-10-16 | — | — | EP | disclosed |
| CN-118382612-A | Method for producing blocked isocyanate compound and method for producing isocyanate compound | 旭化成株式会社 | 2024-07-23 | — | — | CN | disclosed |