Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL29234165 | 0.82 | PARP1 (0.43) | CYP3A4ALDH1A1L3MBTL1CYP19A1PARP1 | |
| SCHEMBL31026612 | 0.78 | SMN1; SMN2 (0.44) | CYP3A4ALDH1A1TSHRTDP1 | |
| SCHEMBL11686437 | 0.76 | FDPS (0.43) | ALDH1A1FDPS | |
| SCHEMBL29234310 | 0.73 | NR3C2 (0.51) | ALDH1A1PARP1 | |
| SCHEMBL1648730 | 0.71 | CYP3A4 (0.42) | CYP3A4ALDH1A1TSHRTDP1L3MBTL1 | |
| SCHEMBL28867968 | 0.70 | PDE4A (0.37) | CYP3A4ALDH1A1TSHRPARP1KMT2A | |
| SCHEMBL4256418 | 0.68 | AGTR1 (0.41) | CYP3A4ALDH1A1TSHRTDP1L3MBTL1 | |
| SCHEMBL7908694 | 0.67 | ALDH1A1 (0.53) | CYP3A4ALDH1A1TSHRTDP1L3MBTL1 | |
| SCHEMBL19468241 | 0.65 | CYP11B1 (0.34) | ALDH1A1CYP11B1CYP11B2CYP19A1KMT2A | |
| SCHEMBL31647881 | 0.65 | PARP1 (0.36) | PARP1 |
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-2025243042-A1 | COMPOUNDS FOR THE INHIBITION OF CYCLOPHILIN D | THE UNIVERSITY OF LIVERPOOL (GB) | 2025-11-27 | — | — | WO | disclosed |