Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.49 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | GCGR | P47871 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | ESRRA | P11474 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10110936 | 1.00 | CYP46A1 (0.49) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL10110954 | 0.96 | CYP46A1 (0.46) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL3422005 | 0.84 | CYP46A1 (0.54) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL25871395 | 0.84 | CYP46A1 (0.54) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL13393498 | 0.83 | NPC1 (0.60) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL1046094 | 0.81 | ESRRA (0.46) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL21627244 | 0.81 | PDE3B (0.55) | CYP46A1PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL139182 | 0.81 | ESRRA (0.46) | MEN1KMT2AALDH1A1ESRRATDP1 | |
| SCHEMBL30445989 | 0.81 | ESRRA (0.46) | MEN1KMT2AALDH1A1ESRRATDP1 | |
| SCHEMBL8065159 | 0.79 | MAPK14 (0.51) | PDE3BPDE3AGCGRMAPK14 |
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-117164872-A | Preparation method and application of Zn-MOF catalyst with post-synthesis modified pore canal | 沈阳化工大学 | 2023-12-05 | — | — | CN | disclosed |