Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TYMS | P04818 | 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 | |
|---|---|---|---|---|
| SCHEMBL6204224 | 0.91 | TYMS (0.37) | ALDH1A1TDP1MAPTHPGDKDM4E | |
| SCHEMBL5424122 | 0.85 | KDM4E (0.44) | MAOBALDH1A1TDP1POLBPPARG | |
| SCHEMBL6204171 | 0.80 | ALDH1A1 (0.38) | ALDH1A1TDP1POLBMAPTHPGD | |
| SCHEMBL4047340 | 0.79 | PPARG (0.44) | MAOBALDH1A1PPARGCA12CA2 | |
| SCHEMBL5414434 | 0.79 | CYP11B1 (0.37) | CYP11B1CYP11B2NPC1RAB9AHDAC3 | |
| SCHEMBL4043160 | 0.79 | PPARG (0.43) | MAOBALDH1A1PPARGHPGDLMNA | |
| SCHEMBL6204597 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TDP1MAPTHPGDKDM4E | |
| SCHEMBL4045987 | 0.77 | HDAC3 (0.41) | MAOBALDH1A1HPGDKDM4EHDAC3 | |
| SCHEMBL4050340 | 0.77 | CACNA1B (0.42) | MAOBALDH1A1KDM4ETYMSHDAC3 | |
| SCHEMBL4041725 | 0.76 | CACNA1B (0.41) | MAOBALDH1A1KDM4EHDAC3HDAC1 |
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-1492795-B1 | 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF | PLIVA ISTRAZIVACKI INST D O O (HR) | 2005-11-16 | — | — | EP | claimed |