Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555125 | 0.95 | ADRB2 (0.34) | ALKALDH1A1TDP1 | |
| SCHEMBL9792019 | 0.91 | ALDH1A1 (0.42) | ALDH1A1ESR1CHRM1TSHRSLC6A2 | |
| SCHEMBL9791903 | 0.89 | ESR1 (0.44) | ALDH1A1ESR1TSHR | |
| SCHEMBL8553995 | 0.88 | MAPT (0.34) | ALDH1A1ESR1CHRM1TSHRSLC6A2 | |
| SCHEMBL9791974 | 0.87 | ALDH1A1 (0.46) | ALDH1A1ESR1TSHR | |
| SCHEMBL9792064 | 0.87 | ALDH1A1 (0.46) | ALDH1A1ESR1TSHR | |
| SCHEMBL8554378 | 0.87 | CYP3A4 (0.40) | ALDH1A1TSHR | |
| SCHEMBL9791939 | 0.87 | ALDH1A1 (0.46) | ALDH1A1ESR1TSHR | |
| SCHEMBL9792114 | 0.87 | ESR1 (0.46) | ALDH1A1ESR1TSHRSLC6A2TDP1 | |
| SCHEMBL9791942 | 0.87 | PLA2G1B (0.37) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0507950-B1 | PROCESS FOR PRODUCING DIACETALS | NEW JAPAN CHEM CO LTD (JP) | 1998-04-08 | — | — | EP | disclosed |
| EP-0507950-A1 | PROCESS FOR PRODUCING DIACETAL | NEW JAPAN CHEMICAL CO.,LTD. (JP) | 1992-10-14 | — | — | EP | disclosed |