Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A1 | P43005 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | CPA3 | P15088 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21048725 | 0.82 | SLC1A1 (0.55) | SLC1A1CA1CPA1CPB1CPA3 | |
| SCHEMBL1703530 | 0.78 | CA1 (0.47) | SLC1A1CA1PPARACA2CA7 | |
| SCHEMBL1705704 | 0.78 | CA1 (0.47) | SLC1A1CA1PPARACA2CA7 | |
| SCHEMBL24024089 | 0.76 | MMP2 (0.51) | CPA1CPB1CPA3CPB2MMP2 | |
| SCHEMBL4433529 | 0.75 | SLC1A1 (0.49) | SLC1A1CA1NPC1CA2CA7 | |
| SCHEMBL4433522 | 0.75 | SLC1A1 (0.49) | SLC1A1CA1NPC1CA2CA7 | |
| SCHEMBL8839263 | 0.74 | SLC1A1 (0.73) | SLC1A1CA1CPA1CPB1CPA3 | |
| SCHEMBL14347445 | 0.74 | PPARA (0.52) | SLC1A1CA1PPARACA2CA7 | |
| SCHEMBL4842363 | 0.73 | CA1 (0.64) | SLC1A1CA1MMP2MMP12NPC1 | |
| SCHEMBL4836421 | 0.73 | CA1 (0.64) | SLC1A1CA1MMP2MMP12NPC1 |
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-3141601-B1 | DOUBLE-CARBONYL REDUCTASE MUTANT AND APPLICATION OF SAME | ASYMCHEM LAB TIANJIN CO LTD (CN) | 2019-06-12 | — | — | EP | claimed |