Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | F7 | P08709 | 4/20 | 0.53 |
| ▸ | F3 | P13726 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.53 |
| ▸ | PPARG | P37231 | 3/20 | 0.53 |
| ▸ | BLM | P54132 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | PPARD | Q03181 | 3/20 | 0.53 |
| ▸ | PPARA | Q07869 | 3/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12614586 | 1.00 | ALDH1A1 (0.59) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL12614584 | 1.00 | ALDH1A1 (0.59) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL28380125 | 0.98 | ALDH1A1 (0.57) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL3663321 | 0.95 | ALDH1A1 (0.68) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL31307952 | 0.93 | HSD17B10 (0.49) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL3660737 | 0.90 | FAAH (0.58) | HSD17B10CYP3A4ALOX15TDP1F7 | |
| SCHEMBL3660734 | 0.90 | FAAH (0.58) | HSD17B10CYP3A4ALOX15TDP1F7 | |
| SCHEMBL4263808 | 0.90 | FAAH (0.58) | HSD17B10CYP3A4ALOX15TDP1F7 | |
| SCHEMBL16577202 | 0.88 | ADORA3 (0.66) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 | |
| SCHEMBL18250207 | 0.88 | ADORA3 (0.66) | ALDH1A1HSD17B10CYP3A4ALOX15TDP1 |
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-110446495-B | Delta opioid receptor modulating compounds containing 7-membered aza heterocycles and methods of use and preparation thereof | 特维娜有限公司 | 2023-09-05 | — | — | CN | disclosed |