Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.52 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.48 |
| ▸ | CCR6 | P51684 | 1/20 | 0.45 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 3/20 | 0.43 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | SNCA | P37840 | 1/20 | 0.43 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.43 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.43 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.43 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31189139 | 0.83 | MAOA (0.64) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL29241865 | 0.83 | MAOA (0.64) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL183521 | 0.81 | MAOA (0.48) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL25834322 | 0.76 | MAPT (0.53) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL197980 | 0.76 | PTPN1 (0.59) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL6454954 | 0.74 | PTPN1 (0.56) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL4300573 | 0.74 | MAOA (0.53) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL10877387 | 0.74 | PTPN11 (0.62) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL27858430 | 0.74 | MAOA (0.70) | MAOAMAOBHSD17B3CCR6HKDC1 | |
| SCHEMBL25834448 | 0.74 | MAOA (0.59) | MAOAMAOBHSD17B3CCR6HKDC1 |
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-108401430-B | 2- (3-ethylsulfonylpyridin-2-yl) -5- (trifluoromethanesulfonyl) benzoxazole crystals | 住友化学株式会社 | 2021-06-29 | — | — | CN | disclosed |