Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | GALR2 | O43603 | 1/20 | 0.49 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
| ▸ | CCR6 | P51684 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL1727258 | 0.87 | ALDH1A1 (0.53) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL8954112 | 0.84 | SMN1; SMN2 (0.58) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL9721603 | 0.82 | ALDH1A1 (0.58) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL12215941 | 0.82 | LMNA (0.50) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL28427888 | 0.81 | SMN1; SMN2 (0.53) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL2128713 | 0.80 | SMN1; SMN2 (0.54) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL8767018 | 0.80 | LMNA (0.58) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL6492987 | 0.79 | LMNA (0.53) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL25302839 | 0.79 | SMN1; SMN2 (0.48) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 | |
| SCHEMBL2554500 | 0.78 | KMT2A (0.55) | ALDH1A1NPSR1SMN1; SMN2POLBGALR2 |
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-2023131333-A1 | BENZIMIDAZOLE COMPOUND AND MEDICAL USE THEREOF | 中国科学院上海药物研究所 | 2023-07-13 | — | — | WO | disclosed |