Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NTSR1 | P30989 | 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 | |
|---|---|---|---|---|
| SCHEMBL19073839 | 0.78 | ALDH1A1 (0.41) | NR4A1NR4A2NR4A3MAPTCYP3A4 | |
| SCHEMBL5857387 | 0.78 | MAPT (0.58) | NR4A1NR4A2NR4A3MAPTCA2 | |
| SCHEMBL5857393 | 0.78 | MAPT (0.58) | NR4A1NR4A2NR4A3MAPTCA2 | |
| SCHEMBL22313960 | 0.75 | NR4A1 (0.40) | NR4A1NR4A2NR4A3MAPTCA2 | |
| SCHEMBL12657661 | 0.73 | CA2 (0.36) | MAPTCA2ALDH1A1HTTGAA | |
| SCHEMBL15202933 | 0.71 | CA2 (0.45) | CA2ALDH1A1LMNAHTTNPSR1 | |
| SCHEMBL22912125 | 0.70 | NR4A1 (0.42) | NR4A1NR4A2NR4A3MAPTALDH1A1 | |
| SCHEMBL12921562 | 0.70 | ALDH1A1 (0.52) | NR4A1NR4A2NR4A3MAPTALDH1A1 | |
| SCHEMBL9609511 | 0.70 | ALDH1A1 (0.52) | NR4A1NR4A2NR4A3MAPTALDH1A1 | |
| SCHEMBL14731820 | 0.70 | ALDH1A1 (0.52) | NR4A1NR4A2NR4A3MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023063884-A2 | GENERATION OF CHIRAL SULFINATE ESTERS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2023-04-20 | — | — | WO | disclosed |