Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.90 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.79 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.79 |
| ▸ | GAA | P10253 | 1/20 | 0.73 |
| ▸ | MEN1 | O00255 | 3/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | HTR1A | P08908 | 1/20 | 0.66 |
| ▸ | DRD2 | P14416 | 1/20 | 0.66 |
| ▸ | HTR2B | P41595 | 1/20 | 0.66 |
| ▸ | CASP1 | P29466 | 1/20 | 0.64 |
| ▸ | CASP4 | P49662 | 1/20 | 0.64 |
| ▸ | CASP5 | P51878 | 1/20 | 0.64 |
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | FAAH | O00519 | 1/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL20804357 | 1.00 | SIGMAR1 (0.90) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL21733083 | 0.93 | SIGMAR1 (0.79) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL14076364 | 0.93 | SIGMAR1 (0.79) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL3162705 | 0.93 | SIGMAR1 (0.79) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL30774908 | 0.93 | SIGMAR1 (0.79) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL22642361 | 0.92 | SIGMAR1 (0.77) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL656952 | 0.92 | SIGMAR1 (0.77) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL29447356 | 0.91 | SIGMAR1 (0.77) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL1883482 | 0.91 | SIGMAR1 (0.77) | SIGMAR1KDM4EALDH1A1GAAMEN1 | |
| SCHEMBL27253620 | 0.91 | SIGMAR1 (0.80) | SIGMAR1KDM4EALDH1A1GAAMEN1 |
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-107406426-A | Cyclic ureas as ROCK inhibitors | 百时美施贵宝公司 | 2017-11-28 | — | — | CN | disclosed |