Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | PTP4A3 | O75365 | 2/20 | 0.41 |
| ▸ | PTP4A2 | Q12974 | 2/20 | 0.41 |
| ▸ | PTP4A1 | Q93096 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27936092 | 0.81 | CA1 (0.47) | PTGS2ALDH1A1GAAMAPTHTT | |
| SCHEMBL15506125 | 0.80 | PIK3CD (0.37) | PTGS2ALDH1A1MAPTKDM4EHTT | |
| SCHEMBL14660518 | 0.79 | ALOX5 (0.60) | ALOX5PTGS2EGFRALDH1A1GAA | |
| SCHEMBL12766044 | 0.79 | PTGS2 (0.60) | ALOX5PTGS2EGFRALDH1A1GAA | |
| SCHEMBL150589 | 0.76 | MAPT (0.50) | ALDH1A1GAAMAPTKDM4EHTT | |
| SCHEMBL10345419 | 0.76 | CA2 (0.41) | ALDH1A1MAPTKDM4EHTTL3MBTL1 | |
| SCHEMBL29899617 | 0.76 | CA2 (0.41) | ALDH1A1MAPTKDM4EHTTL3MBTL1 | |
| SCHEMBL17694500 | 0.75 | PIK3CD (0.34) | PTGS2ALDH1A1MAPTKDM4EHTT | |
| SCHEMBL1020821 | 0.74 | PTGS2 (0.57) | PTGS2MAPT | |
| SCHEMBL9719008 | 0.74 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTKDM4EHTT |
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-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |