Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28127494 | 0.91 | ALDH1A1 (0.46) | HTTKDM4EALDH1A1MAPTCNR2 | |
| SCHEMBL28127413 | 0.90 | CNR2 (0.46) | PDE4APDE4BPDE4CPDE4DHTT | |
| SCHEMBL28127530 | 0.88 | CNR2 (0.53) | HTTKDM4ELMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28379309 | 0.87 | F2RL3 (0.50) | KDM4ELMNAALDH1A1F2RL3MAPT | |
| SCHEMBL2214591 | 0.82 | GAA (0.50) | KDM4ELMNAALDH1A1F2RL3MAPT | |
| SCHEMBL28127173 | 0.81 | PDE4A (0.50) | PDE4APDE4BPDE4CPDE4DHTT | |
| SCHEMBL28376283 | 0.80 | MDM2 (0.54) | HTTKDM4EALDH1A1SMN1; SMN2RXFP1 | |
| SCHEMBL28127171 | 0.80 | KDM4E (0.52) | KDM4ELMNAALDH1A1F2RL3CNR2 | |
| SCHEMBL28376586 | 0.79 | GABRA2 (0.48) | HTTKDM4EALDH1A1MAPTCNR2 | |
| SCHEMBL2216447 | 0.78 | CNR2 (0.49) | PDE4APDE4BPDE4CPDE4DKDM4E |
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-106349257-B | The double B-carboline alkaloid compounds and its pharmaceutical applications that 3 piperazine bridgings connect | 新疆华世丹药物研究有限责任公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-106349257-A | 3-bit piperazine bridge connected di-beta-carboline alkali type compound and pharmaceutical application thereof | 新疆华世丹药物研究有限责任公司 | 2017-01-25 | — | — | CN | disclosed |