Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21650581 | 0.88 | KMT2A (0.47) | CTRB1MAPK14MEN1KMT2AMCHR1 | |
| SCHEMBL31066573 | 0.86 | CTRB1 (0.55) | CTRB1MAPK14DAO | |
| SCHEMBL31066580 | 0.86 | POLB (0.46) | ALDH1A1MEN1KMT2AMCHR1 | |
| SCHEMBL21634096 | 0.86 | POLB (0.46) | ALDH1A1MEN1KMT2AMCHR1 | |
| SCHEMBL12640061 | 0.84 | MAPK14 (0.52) | MAPK14 | |
| SCHEMBL21634140 | 0.84 | NPC1 (0.48) | ALDH1A1MAPTCTRB1NPC1MMP13 | |
| SCHEMBL31066644 | 0.84 | NPC1 (0.48) | ALDH1A1MAPTCTRB1NPC1MMP13 | |
| SCHEMBL20503971 | 0.77 | FLT1 (0.48) | ALDH1A1MAPK14KMT2ADAOCYP19A1 | |
| SCHEMBL17457967 | 0.76 | KMT2A (0.51) | KMT2ADAOCYP19A1 | |
| SCHEMBL12734354 | 0.73 | ACACB (0.42) | MAPTMEN1KMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3827004-B1 | 4-(1,3,4-OXADIAZOLE-2-YL)PYRIDINE-2(1H)-ONE DERIVATIVES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS FOR THE TREATMENT OF E.G. INFECTIONS | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2023-10-11 | — | — | EP | disclosed |