Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL10951502 | 0.78 | CYP3A4 (0.39) | KMT2AL3MBTL1MEN1 | |
| SCHEMBL3119634 | 0.78 | ADRB2 (0.40) | LMNAMAPK1TSHRCYP2A6 | |
| SCHEMBL10404002 | 0.77 | TSHR (0.33) | CYP2D6LMNADPP4F2TSHR | |
| SCHEMBL7206079 | 0.77 | LMNA (0.35) | KMT2ALMNADPP4F2TSHR | |
| SCHEMBL15564590 | 0.77 | CFTR (0.44) | LMNATSHRCYP2A6L3MBTL1 | |
| SCHEMBL21870359 | 0.76 | MEN1 (0.35) | CYP2D6KMT2ALMNADPP4F2 | |
| SCHEMBL23628841 | 0.72 | TSHR (0.38) | CYP2D6KMT2ASRCLMNADPP4 | |
| SCHEMBL31347982 | 0.72 | CYP2D6 (0.35) | CYP2D6KMT2AALOX5LMNAALDH1A1 | |
| SCHEMBL4068170 | 0.72 | TSHR (0.38) | CYP2D6KMT2ASRCLMNADPP4 | |
| SCHEMBL8812923 | 0.72 | TRPA1 (0.35) | CYP2D6KMT2ASRCLMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107556223-A | A kind of preparation method of 4 mesyl phenylacetic acid | 孙家强 | 2018-01-09 | — | — | CN | disclosed |