Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 3/20 | 0.45 |
| ▸ | CTSS | P25774 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6500768 | 0.83 | CASP1 (0.56) | CASP1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6501321 | 0.83 | CASP1 (0.56) | CASP1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13168669 | 0.81 | CASP1 (0.56) | CASP1ALDH1A1ALOX15LMNAATM | |
| SCHEMBL29207429 | 0.81 | CASP1 (0.63) | CASP1LMNAATMTOP2ATOP2B | |
| SCHEMBL10577245 | 0.80 | CASP1 (0.54) | CASP1CTSLCTSSPLAUCTRB1 | |
| SCHEMBL6487625 | 0.80 | CASP1 (0.57) | CASP1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7141233 | 0.78 | CASP1 (0.60) | CASP1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8346816 | 0.76 | CTSL (0.62) | CASP1ALDH1A1CTSLCTSSALOX15 | |
| SCHEMBL6436627 | 0.76 | CTSL (0.62) | CASP1ALDH1A1CTSLCTSSALOX15 | |
| SCHEMBL17704241 | 0.76 | CTSL (0.62) | CASP1ALDH1A1CTSLCTSSALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1346972-A1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE HALOHYDRIN COMPOUND | Ajinomoto Co., Inc. (JP) | 2003-09-24 | — | — | EP | disclosed |