Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28738977 | 1.00 | HPGD (0.53) | HPGDKMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL28739132 | 0.90 | KEAP1 (0.44) | HPGDKMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL29644302 | 0.90 | KEAP1 (0.44) | HPGDKMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL29644406 | 0.89 | HPGD (0.60) | HPGDKMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL28739130 | 0.89 | HPGD (0.60) | HPGDKMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL28739006 | 0.87 | KMT2A (0.45) | HPGDKMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL29644435 | 0.87 | KMT2A (0.45) | HPGDKMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL29201149 | 0.86 | MEN1 (0.48) | KMT2AMEN1SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL30768144 | 0.86 | MEN1 (0.48) | KMT2AMEN1SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL28739027 | 0.86 | HPGD (0.58) | HPGDKMT2AMEN1SMN1; SMN2ALDH1A1 |
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-114507181-A | Propionic acid compound containing 5-substituted tetrahydroisoquinoline, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-05-17 | — | — | CN | disclosed |