Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30584939 | 1.00 | CYP19A1 (0.50) | CYP19A1CYP11B1CYP11B2KDM4EALDH1A1 | |
| SCHEMBL5767415 | 0.87 | P2RX7 (0.48) | ALDH1A1TSHRTP53MAPTGAA | |
| SCHEMBL25402399 | 0.86 | L3MBTL1 (0.48) | ALDH1A1HTTTDP1POLBKDM4C | |
| SCHEMBL30585030 | 0.85 | HDAC6 (0.51) | ALDH1A1 | |
| SCHEMBL25399686 | 0.85 | HDAC6 (0.51) | ALDH1A1 | |
| SCHEMBL25403016 | 0.82 | MRGPRX4 (0.46) | KDM4EALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL25399737 | 0.82 | CD74 (0.48) | MAPT | |
| SCHEMBL25401651 | 0.82 | THRB (0.53) | KDM4ETP53MAPTKLKB1 | |
| SCHEMBL25403100 | 0.82 | POLB (0.46) | KDM4EALDH1A1ALOX15HTTPOLB | |
| SCHEMBL25402366 | 0.81 | HDAC6 (0.49) | SMN1; SMN2MAPTNPSR1KLKB1GAA |
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-2023177250-A1 | NOVEL HETEROCYCLIC INHIBITOR FOR HISTONE DEACETYLASE, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 숙명여자대학교산학협력단 | 2023-09-21 | — | — | WO | disclosed |