Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28446927 | 0.87 | HPGD (0.35) | HPGDRECQLNPSR1ALDH1A1KCNQ2 | |
| SCHEMBL28449501 | 0.78 | KCNQ2 (0.44) | HPGDRECQLNPSR1ALDH1A1KCNQ2 | |
| SCHEMBL28457125 | 0.72 | ALDH1A1 (0.49) | HPGDNPSR1ALDH1A1 | |
| SCHEMBL28796833 | 0.70 | HPGD (0.36) | HPGDRECQLNPSR1ALDH1A1 | |
| SCHEMBL16147790 | 0.70 | TMEM97 (0.41) | HPGDALDH1A1PTGDR2 | |
| SCHEMBL22981745 | 0.68 | NPC1 (0.35) | HPGDALDH1A1PTGDR2 | |
| SCHEMBL14832181 | 0.67 | CYP2C19 (0.40) | HPGDNPSR1ALDH1A1 | |
| SCHEMBL3441449 | 0.67 | HDAC6 (0.42) | — | |
| SCHEMBL18584701 | 0.67 | ABHD6 (0.43) | HPGDALDH1A1 | |
| SCHEMBL28901663 | 0.67 | MAPK1 (0.34) | HPGDRECQLNPSR1ALDH1A1 |
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-107922430-B | 2-substituted benzimidazole-4-formamide compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2020-09-04 | — | — | CN | disclosed |