Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.73 |
| ▸ | CA2 | P00918 | 3/20 | 0.73 |
| ▸ | CA9 | Q16790 | 3/20 | 0.73 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.73 |
| ▸ | CA12 | O43570 | 2/20 | 0.73 |
| ▸ | CA6 | P23280 | 2/20 | 0.73 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.73 |
| ▸ | POLB | P06746 | 1/20 | 0.73 |
| ▸ | GAA | P10253 | 1/20 | 0.73 |
| ▸ | MAPT | P10636 | 1/20 | 0.73 |
| ▸ | CA4 | P22748 | 1/20 | 0.73 |
| ▸ | CA7 | P43166 | 1/20 | 0.73 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.73 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.52 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.51 |
| ▸ | FASN | P49327 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Protocatechuic Acid SCHEMBL28487427 | 0.88 | CA12 (0.95) | CA1CA2CA9L3MBTL1CA12 | |
| SCHEMBL31257839 | 0.86 | L3MBTL1 (0.64) | CA1CA2CA9L3MBTL1CA12 | |
| SCHEMBL142204 | 0.86 | L3MBTL1 (0.64) | CA1CA2CA9L3MBTL1CA12 | |
| Protocatechuic Acid SCHEMBL5137526 | 0.86 | CA12 (0.83) | CA1CA2CA9L3MBTL1CA12 | |
| SCHEMBL766131 | 0.85 | ATM (0.76) | CA1CA2CA9L3MBTL1CA12 | |
| Protocatechuic Acid SCHEMBL39435 | 0.85 | CA12 (1.00) | CA1CA2CA9L3MBTL1CA12 | |
| Protocatechuic Acid SCHEMBL30030432 | 0.85 | CA12 (1.00) | CA1CA2CA9L3MBTL1CA12 | |
| Protocatechuic Acid SCHEMBL29350008 | 0.85 | CA12 (1.00) | CA1CA2CA9L3MBTL1CA12 | |
| Protocatechuic Acid SCHEMBL27815804 | 0.85 | CA12 (1.00) | CA1CA2CA9L3MBTL1CA12 | |
| SCHEMBL9752049 | 0.84 | HSD17B1 (0.59) | CA1CA2CA9L3MBTL1CA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0549621-B1 | NEW LEUKOTRIENE-B4 ANTAGONISTS, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS MEDICINAL DRUGS | SCHERING AG (DE) | 1995-09-27 | — | — | EP | disclosed |
| US-5352701-A | Leukotriene-B4 antagonist compounds and their use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-10-04 | — | — | US | disclosed |
| WO-1992004311-A1 | NEW LEUKOTRIENE-B4 ANTAGONISTS, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS MEDICINAL DRUGS | SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) | 1992-03-19 | — | — | WO | disclosed |