Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 7/20 | 0.65 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | RAB9A | P51151 | 6/20 | 0.63 |
| ▸ | NPC1 | O15118 | 4/20 | 0.63 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.60 |
| ▸ | GAA | P10253 | 5/20 | 0.60 |
| ▸ | MEN1 | O00255 | 5/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.57 |
| ▸ | MAOA | P21397 | 2/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL15484245 | 0.87 | MAPT (0.75) | ALDH1A1MAPTLMNARAB9ANPC1 | |
| SCHEMBL11674611 | 0.86 | KMT2A (0.75) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL18257738 | 0.84 | MAPT (0.58) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL5451731 | 0.83 | ALDH1A1 (0.74) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL132620 | 0.82 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL9470190 | 0.80 | ALDH1A1 (0.94) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL8956322 | 0.80 | ALDH1A1 (0.94) | ALDH1A1CYP3A4TAS2R38HSD17B10MAPT | |
| SCHEMBL12472927 | 0.80 | LMNA (1.00) | ALDH1A1MAPTLMNAALOX12KMT2A | |
| SCHEMBL30557461 | 0.79 | MEN1 (0.77) | ALDH1A1CYP3A4HSD17B10MAPTLMNA | |
| SCHEMBL9453941 | 0.79 | MEN1 (0.77) | ALDH1A1CYP3A4HSD17B10MAPTLMNA |
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-109843949-A | Thio guanidine IV group 4 transition metal catalyst and paradigmatic system | 陶氏环球技术有限责任公司 | 2019-06-04 | — | — | CN | disclosed |