Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DBH | P09172 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.36 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27988480 | 0.84 | DBH (0.41) | DBHDRD2DRD3KCNH2P2RX7 | |
| SCHEMBL28804075 | 0.73 | KDM4E (0.41) | KDM4EALDH1A1DPP4DPP8SIGMAR1 | |
| SCHEMBL30596568 | 0.71 | MEN1 (0.60) | DRD2DRD3KCNH2CYP2A13KDM4E | |
| SCHEMBL1218769 | 0.69 | SIGMAR1 (0.47) | ALDH1A1POLBSIGMAR1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10734550 | 0.69 | MAOA (0.58) | DBHDRD2DRD3KCNH2P2RX7 | |
| SCHEMBL3960480 | 0.66 | CYP2A13 (0.49) | DBHDRD2DRD3KCNH2CYP2A13 | |
| SCHEMBL3960485 | 0.66 | SLC6A2 (0.52) | DBHDRD2DRD3KCNH2CYP2A13 | |
| SCHEMBL28123863 | 0.64 | SMN1; SMN2 (0.50) | DBHDRD2DRD3KCNH2P2RX7 | |
| SCHEMBL6945861 | 0.64 | CCR5 (0.50) | DRD2CYP2A13KDM4EALDH1A1DPP4 | |
| SCHEMBL28256458 | 0.64 | SIGMAR1 (0.49) | MAOBKDM4EALDH1A1MAOASIGMAR1 |
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-101437819-B | Pyridopyrazines and derivatives thereof as alk and c-MET inhibitors | CEPHALON INC | 2013-06-19 | — | — | CN | disclosed |