Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 3/20 | 0.51 |
| ▸ | RORA | P35398 | 2/20 | 0.51 |
| ▸ | RORC | P51449 | 2/20 | 0.51 |
| ▸ | RORB | Q92753 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL16093911 | 0.86 | HASPIN (0.49) | PIM3DYRK1AHPGDG6PDTDP1 | |
| SCHEMBL27908715 | 0.85 | SIGMAR1 (0.49) | ALDH1A1HPGDG6PD | |
| SCHEMBL27921223 | 0.84 | PGR (0.47) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL27908743 | 0.84 | PGR (0.47) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL27979878 | 0.83 | PGR (0.49) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL2215558 | 0.82 | CNR2 (0.50) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL4172231 | 0.80 | CNR2 (0.64) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL17102927 | 0.79 | DYRK1A (0.65) | PGRRORARORCRORBDYRK1A | |
| SCHEMBL27891716 | 0.79 | CYP19A1 (0.56) | ALDH1A1DYRK1AKDM4EHPGDTDP1 | |
| Fluoride SCHEMBL27921184 | 0.79 | DYRK1A (0.43) | PGRRORARORCRORBALDH1A1 |
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-102146080-B | Beta-carboline alkali derivative compounds and application thereof | XINJIANG HUASHIDAN PHARMACEUTICAL CO LTD | 2013-01-30 | — | — | CN | claimed |