Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.75 |
| ▸ | NPC1 | O15118 | 3/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.75 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | GRK2 | P25098 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30097180 | 1.00 | RAB9A (0.75) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL30097169 | 1.00 | RAB9A (0.75) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL31344799 | 0.88 | RAB9A (0.58) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL21815107 | 0.81 | RAB9A (0.54) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL21814818 | 0.77 | GABRP (0.51) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL4457699 | 0.76 | RAB9A (0.59) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL698545 | 0.75 | NPC1 (0.61) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL30097124 | 0.75 | RAB9A (0.78) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL1128181 | 0.75 | RAB9A (0.62) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL15858023 | 0.73 | KDM4E (0.53) | RAB9ANPC1ALDH1A1SMN1; SMN2MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117136187-A | Novel anti-hepatitis B compound | 上海齐鲁制药研究中心有限公司 | 2023-11-28 | — | — | CN | disclosed |
| WO-2022268154-A1 | NEW ANTI-HEPATITIS B COMPOUND | 上海齐鲁制药研究中心有限公司 | 2022-12-29 | — | — | WO | disclosed |