Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.39 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | TYMP | P19971 | 5/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | PNP | P00491 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20853010 | 0.81 | TYMP (0.39) | PARP1GDAKDM4ECA12CA9 | |
| SCHEMBL5357075 | 0.75 | SIRT2 (0.44) | PARP1KDM4ECA12CA9ALDH1A1 | |
| SCHEMBL2267356 | 0.75 | CHUK (0.36) | PARP1ALDH1A1 | |
| SCHEMBL6199860 | 0.72 | PARP1 (0.67) | PARP1KDM4ECA12CA9ALDH1A1 | |
| SCHEMBL4610600 | 0.68 | PARP1 (0.62) | PARP1KDM4ECA12CA9ALDH1A1 | |
| SCHEMBL3423565 | 0.68 | KDM4E (0.50) | PARP1GDAKDM4ECA12CA9 | |
| SCHEMBL7031558 | 0.65 | PARP1 (0.37) | PARP1GDAKDM4ECA12CA9 | |
| SCHEMBL29937099 | 0.65 | MAP2 (0.42) | PARP1GDAKDM4ECA12CA9 | |
| SCHEMBL21230968 | 0.65 | PARP1 (0.37) | PARP1GDAKDM4ECA12CA9 | |
| SCHEMBL27142990 | 0.65 | MAP2 (0.42) | PARP1GDAKDM4ECA12CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1222191-A2 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-17 | — | — | EP | claimed |
| WO-2001023386-A2 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2001-04-05 | — | — | WO | claimed |
| EP-1222191-B1 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | ABBOTT GMBH & CO KG (DE) | 2005-11-16 | — | — | EP | disclosed |
| US-4247296-A | Diazo pigments | BASF FARBEN & FASERN AG (DE) | 1981-01-27 | — | — | US | disclosed |