Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 10/20 | 0.40 |
| ▸ | CA1 | P00915 | 9/20 | 0.40 |
| ▸ | CA9 | Q16790 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11315254 | 0.85 | LRRK2 (0.41) | LRRK2CA2CA1CA9ALDH1A1 | |
| SCHEMBL10586071 | 0.84 | TIMP3 (0.44) | ALDH1A1MAPTCASP6KMT2ASNCA | |
| SCHEMBL10585378 | 0.81 | TIMP3 (0.35) | ALDH1A1CASP6KMT2ASNCA | |
| SCHEMBL9009756 | 0.78 | CA2 (0.46) | LRRK2CA2CA1CA9 | |
| SCHEMBL11532173 | 0.78 | CA1 (0.34) | CA2CA1CA9ALDH1A1KMT2A | |
| SCHEMBL7718715 | 0.76 | LRRK2 (0.40) | LRRK2CA2CA1CA9SNCA | |
| SCHEMBL11532165 | 0.76 | LRRK2 (0.41) | LRRK2CA2CA1TTKCDK2 | |
| SCHEMBL7684666 | 0.74 | SNCA (0.42) | CA2CA1CA9ALDH1A1MAPT | |
| SCHEMBL11531321 | 0.74 | FUT8 (0.42) | LRRK2CA2CA1KMT2ATTK | |
| SCHEMBL6846772 | 0.73 | TNNI3K (0.48) | ALDH1A1CASP6CDK2SNCAHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| JP-6329937-A | — | — | None | — | — | JP | disclosed |
| JP-H06329937-A | REACTIVE DYE | BAYER AG | 1994-11-29 | — | — | JP | disclosed |