Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 4/20 | 0.49 |
| ▸ | CA1 | P00915 | 4/20 | 0.49 |
| ▸ | CA2 | P00918 | 4/20 | 0.49 |
| ▸ | CA7 | P43166 | 4/20 | 0.49 |
| ▸ | CA9 | Q16790 | 4/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.49 |
| ▸ | XDH | P47989 | 1/20 | 0.49 |
| ▸ | TOP1 | P11387 | 3/20 | 0.47 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.44 |
| ▸ | ESRRG | P62508 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SNCA | P37840 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9072116 | 0.87 | ALDH1A1 (0.39) | MAPTGAARECQL | |
| SCHEMBL3568864 | 0.85 | ALDH1A1 (0.51) | MAPTKDM4EGAAPOLBRECQL | |
| SCHEMBL1477613 | 0.83 | MIF (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4362534 | 0.81 | HDAC6 (0.72) | HDAC6CA12CA1CA2CA7 | |
| SCHEMBL17934355 | 0.81 | HDAC6 (0.46) | HDAC6CA12CA1CA2CA7 | |
| SCHEMBL17172491 | 0.79 | ALDH1A1 (0.66) | HDAC6KDM4EGAA | |
| SCHEMBL17680509 | 0.79 | POLB (0.53) | MAPTGAAPOLBL3MBTL1RECQL | |
| SCHEMBL13605085 | 0.79 | MAPT (0.63) | HDAC6ESRRGMAPTGAAPOLB | |
| SCHEMBL14288997 | 0.79 | HDAC6 (0.55) | HDAC6CA12CA1CA2CA7 | |
| SCHEMBL4866471 | 0.78 | MTOR (0.44) | GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4680409-A | CEPHALOSPORIN INTERMEDIATES | E. R. SQUIBB & SONS, INC. (US) | 1987-07-14 | — | — | US | disclosed |