Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6155710 | 0.84 | GAA (0.39) | TSHRALDH1A1TDP1GAARECQL | |
| SCHEMBL6154560 | 0.81 | RECQL (0.33) | TSHRALDH1A1L3MBTL1RECQLMAPT | |
| SCHEMBL6155702 | 0.80 | TSHR (0.34) | TSHRALDH1A1POLBGAA | |
| SCHEMBL6155426 | 0.79 | MAPT (0.40) | TSHRALDH1A1HPGDL3MBTL1RECQL | |
| SCHEMBL6233376 | 0.78 | TSHR (0.39) | TSHRALDH1A1PRKCATDP1L3MBTL1 | |
| SCHEMBL6155439 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL6241318 | 0.76 | RAB9A (0.45) | TSHRALDH1A1HPGDTDP1GAA | |
| SCHEMBL6154085 | 0.76 | CYP2D6 (0.40) | — | |
| SCHEMBL6157808 | 0.76 | SLC22A6 (0.48) | TSHRALDH1A1TDP1MAPT | |
| SCHEMBL9328721 | 0.76 | SLC22A6 (0.48) | TSHRALDH1A1TDP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005005375-A1 | METHOD FOR PRODUCING 4-CYANO-3-HYDROXYBUTYRIC ACID ESTERS | LANXESS DEUTSCHLAND GMBH (DE) | 2005-01-20 | — | — | WO | claimed |
| WO-2005005375-A1 | METHOD FOR PRODUCING 4-CYANO-3-HYDROXYBUTYRIC ACID ESTERS | LANXESS DEUTSCHLAND GMBH (DE) | 2005-01-20 | — | — | WO | disclosed |