Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | PLG | P00747 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.44 |
| ▸ | KLK1 | P06870 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7440691 | 1.00 | GAA (0.53) | GAAMEN1KMT2AHDAC8SMN1; SMN2 | |
| SCHEMBL27831966 | 0.84 | CASP3 (0.63) | GAAMEN1KMT2AHDAC8SMN1; SMN2 | |
| SCHEMBL6667377 | 0.83 | HDAC8 (0.54) | MEN1KMT2AHDAC8SMN1; SMN2ALDH1A1 | |
| SCHEMBL6669961 | 0.82 | HDAC8 (0.47) | GAAMEN1KMT2AHDAC8SMN1; SMN2 | |
| SCHEMBL23019763 | 0.81 | GAA (0.61) | GAAMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL6672136 | 0.81 | HDAC8 (0.49) | GAAMEN1KMT2AHDAC8SMN1; SMN2 | |
| SCHEMBL6069211 | 0.81 | GAA (0.61) | GAAMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL26342360 | 0.78 | PTGS1 (0.44) | MEN1KMT2ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL11062803 | 0.77 | ALDH1A1 (0.53) | GAAMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL6667919 | 0.77 | HDAC8 (0.46) | GAAHDAC8SMN1; SMN2ALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109651191-B | Difluoromethyl oxime ether derivative and synthetic method thereof | 华南理工大学 | 2021-11-19 | — | — | CN | disclosed |
| US-6187905-B1 | PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES | HOFFMANN-LA ROCHE INC. | 2001-02-13 | — | — | US | disclosed |
| CN-1182423-A | Fungicidal cyclic amides | DU PONT (US) | 1998-05-20 | — | — | CN | disclosed |