Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8726497 | 0.90 | CA1 (0.49) | CA1CA12CA9CA2HDAC1 | |
| SCHEMBL8726226 | 0.86 | CA1 (0.49) | CA1CA12CA9CA2LMNA | |
| SCHEMBL8724180 | 0.84 | CA2 (0.45) | CA1CA12CA9CA2HPGD | |
| SCHEMBL8722967 | 0.84 | ALDH1A1 (0.41) | CA1CA12CA9HDAC1HDAC6 | |
| SCHEMBL8723008 | 0.79 | CA1 (0.42) | CA1CA12CA9CA2RAB9A | |
| SCHEMBL8721928 | 0.77 | CA1 (0.49) | CA1CA12CA9CA2HDAC1 | |
| SCHEMBL8728048 | 0.77 | CA1 (0.40) | CA1CA12CA9CA2ALDH1A1 | |
| SCHEMBL8723006 | 0.75 | DHFR (0.33) | HDAC1HDAC6LMNAALDH1A1CYP1A2 | |
| SCHEMBL8726522 | 0.74 | CA2 (0.46) | CA1CA12CA9CA2HDAC1 | |
| SCHEMBL11103451 | 0.74 | CA2 (0.71) | CA1CA12CA9CA2HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998035982-A1 | COMPOUNDS FOR USE IN ADEPT | ZENECA LIMITED (GB) | 1998-08-20 | — | — | WO | disclosed |