Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17468965 | 0.88 | NAAA (0.38) | NAAADGKAALDH1A1HCAR2L3MBTL1 | |
| SCHEMBL18828587 | 0.86 | MGAM (0.44) | ALDH1A1METAP1L3MBTL1MAPTLMNA | |
| SCHEMBL9149871 | 0.82 | NAAA (0.36) | NAAADGKAALDH1A1HCAR2L3MBTL1 | |
| SCHEMBL28433218 | 0.82 | TSHR (0.39) | NAAADGKAALDH1A1HCAR2L3MBTL1 | |
| SCHEMBL3396326 | 0.80 | MAPT (0.36) | NAAADGKAALDH1A1HCAR2L3MBTL1 | |
| SCHEMBL3393668 | 0.80 | MAPT (0.36) | NAAADGKAALDH1A1HCAR2L3MBTL1 | |
| SCHEMBL19792376 | 0.79 | NAAA (0.48) | NAAADGKAALDH1A1L3MBTL1MAPT | |
| SCHEMBL133737 | 0.79 | MMP1 (0.42) | NAAADGKAALDH1A1HCAR2TDP1 | |
| SCHEMBL17469117 | 0.78 | TDP1 (0.49) | ALDH1A1METAP1MAPTNPSR1LMNA | |
| SCHEMBL17469116 | 0.78 | L3MBTL1 (0.39) | METAP1L3MBTL1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016012362-A1 | SUBSTITUTED CYANO CYCLOALKYL PENTA-2,4-DIENES, CYANO CYCLOALKYL PENT-2-EN-4-YNES, CYANO HETEROCYCLYL PENTA-2,4-DIENES AND CYANO HETEROCYCLYL PENT-2-EN-4-YNES AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-01-28 | — | — | WO | disclosed |