Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 3/20 | 0.45 |
| ▸ | JAK2 | O60674 | 2/20 | 0.45 |
| ▸ | TYK2 | P29597 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CKS1B | P61024 | 1/20 | 0.39 |
| ▸ | SKP1 | P63208 | 1/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.38 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.38 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.38 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17452549 | 0.89 | KMT2A (0.37) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19902579 | 0.79 | KDM1A (0.43) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19902296 | 0.75 | JAK1 (0.49) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19902293 | 0.75 | JAK1 (0.49) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19902295 | 0.75 | JAK1 (0.49) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19902459 | 0.75 | CHRNA7 (0.37) | JAK1JAK2TYK2JAK3DRD2 | |
| SCHEMBL17452779 | 0.70 | KMT2A (0.37) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL19380852 | 0.70 | KDM1A (0.68) | JAK1JAK2TYK2JAK3KDM1A | |
| SCHEMBL9638796 | 0.67 | KDM1A (0.55) | KDM1AMAOBBTKDRD2CKS1B | |
| SCHEMBL20563839 | 0.67 | JAK1 (0.49) | JAK1JAK2TYK2JAK3KDM1A |
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 |
|---|---|---|---|---|---|---|---|
| US-9902702-B2 | Spirocycloheptanes as inhibitors of rock | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-02-27 | — | — | US | disclosed |