Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | BID | P55957 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11850413 | 0.92 | BID (0.46) | MAOAMAOBBIDBCL2L1MCL1 | |
| SCHEMBL4705461 | 0.88 | MAOA (0.43) | PTGS1PTGS2MAOAMAOBTDP1 | |
| SCHEMBL2804823 | 0.86 | MAOA (0.42) | PTGS1PTGS2MAOAMAOBBID | |
| SCHEMBL2313646 | 0.85 | MAOA (0.46) | PTGS1PTGS2MAOAMAOBTDP1 | |
| SCHEMBL4743622 | 0.84 | PTGER2 (0.41) | MAOAMAOBBIDBCL2L1MCL1 | |
| SCHEMBL4747073 | 0.84 | MAOA (0.40) | MAOAMAOBBIDBCL2L1MCL1 | |
| SCHEMBL135629 | 0.84 | BID (0.43) | MAOAMAOBBIDBCL2L1MCL1 | |
| SCHEMBL16563060 | 0.83 | MAOA (0.44) | PTGS1PTGS2MAOAMAOBTDP1 | |
| Potassium SCHEMBL4602990 | 0.83 | MAOA (0.44) | PTGS1PTGS2MAOAMAOBTDP1 | |
| SCHEMBL2421075 | 0.83 | MAOA (0.39) | PTGS1PTGS2MAOAMAOBLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1373238-B1 | ALKYLXANTHATES AND THEIR USE AS PESTICIDES | COUNCIL SCIENT IND RES (IN) | 2004-11-03 | — | — | EP | disclosed |
| US-6583175-B2 | Used as insect growth regulatory for pest management in agricultural fields no or less environmental impact | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2003-06-24 | — | — | US | disclosed |