Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | RHOA | P61586 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31182016 | 0.87 | MEN1 (0.57) | MAPTTSHRHPGDSMN1; SMN2MEN1 | |
| SCHEMBL31182001 | 0.87 | HPGD (0.49) | ALDH1A1TSHRHPGDUSP2POLB | |
| SCHEMBL31182003 | 0.87 | HPGD (0.49) | ALDH1A1TSHRHPGDUSP2POLB | |
| SCHEMBL31181983 | 0.81 | HPGD (0.42) | ALDH1A1MAPTRHOAHPGDNPC1 | |
| SCHEMBL31182012 | 0.71 | CCNC (0.47) | — | |
| SCHEMBL829186 | 0.68 | ALDH1A1 (0.51) | ALDH1A1MAPTTSHRHPGDSMN1; SMN2 | |
| SCHEMBL10720608 | 0.66 | TSHR (0.69) | ALDH1A1MAPTTSHRRECQLHPGD | |
| SCHEMBL18228404 | 0.64 | HPGD (0.96) | ALDH1A1HPGDMAPK1L3MBTL1USP2 | |
| SCHEMBL10860632 | 0.64 | GPR3 (0.46) | ALDH1A1MAPTRHOAHPGDSMN1; SMN2 | |
| SCHEMBL254870 | 0.64 | HPGD (0.96) | ALDH1A1HPGDMAPK1L3MBTL1USP2 |
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-118878508-A | DC-Rhoin derivative, preparation method and application thereof | 广东省中医院（广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院） | 2024-11-01 | — | — | CN | disclosed |