Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 4/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4789433 | 0.81 | CHRNB2 (0.53) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL1787933 | 0.80 | CHRNB2 (0.50) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL28187918 | 0.77 | ALDH1A1 (0.63) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL19779511 | 0.77 | ALDH1A1 (0.63) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL14047773 | 0.76 | CHRM2 (0.71) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL11175416 | 0.75 | MAPK1 (0.48) | ALDH1A1LMNAMAPK1CHRNB2CHRNB4 | |
| SCHEMBL29117240 | 0.75 | CTSL (0.49) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL29117236 | 0.75 | CTSL (0.49) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL27741091 | 0.74 | CHRM2 (0.42) | DRD2DRD3KCNH2ALDH1A1LMNA | |
| SCHEMBL21198788 | 0.73 | BCHE (0.58) | ALDH1A1LMNACHRNB2CHRNB4CHRNA3 |
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-101384602-A | Novel, cyclic substituted furopyrimidine derivatives and use thereof for treating cardiovascular diseases | BAYER HEALTHCARE AG (DE) | 2009-03-11 | — | — | CN | disclosed |