Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PAM | P19021 | 1/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11632800 | 0.93 | TSHR (0.56) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4643567 | 0.86 | ALDH1A1 (0.56) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4644597 | 0.84 | TSHR (0.47) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4646684 | 0.82 | MAPT (0.44) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL52219 | 0.82 | ALDH1A1 (0.52) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4643563 | 0.82 | TSHR (0.48) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL1171919 | 0.81 | TSHR (0.52) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL5517752 | 0.81 | NPC1 (0.55) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4646689 | 0.81 | TSHR (0.44) | TSHRALDH1A1L3MBTL1MAPK1NPC1 | |
| SCHEMBL4644595 | 0.81 | MAPT (0.46) | TSHRALDH1A1L3MBTL1MAPK1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5298526-A | Optically pure stereogenically labile 4-substituted-2-hydroxytetronic acids and pharmaceutical use | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 1994-03-29 | — | — | US | disclosed |
| US-5095126-A | Efficient synthesis for optically pure stereogenically labile 4-substituted-2-hydroxytetronic acids | OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 1992-03-10 | — | — | US | disclosed |