Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294625 | 0.81 | NR4A2 (0.52) | APPKDM4ECYP3A4CYP2C19HIF1A | |
| SCHEMBL25722168 | 0.76 | ALDH1A1 (0.51) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL18895408 | 0.76 | DHFR (0.42) | APPPNMTHTTSMN1; SMN2CCR2 | |
| SCHEMBL18895154 | 0.74 | HTT (0.54) | APPKDM4ECYP3A4CYP2C19HTT | |
| SCHEMBL5354603 | 0.73 | HSP90AB1 (0.51) | KDM4ECYP3A4CYP2C19HIF1A | |
| SCHEMBL28957472 | 0.72 | NR4A2 (0.62) | APPPNMTNOS3NOS1MAP4K4 | |
| SCHEMBL8886921 | 0.72 | APP (0.64) | APPHTR6PDE5A | |
| SCHEMBL5355383 | 0.72 | DHFR (0.60) | — | |
| Hydrochloric Acid SCHEMBL8500111 | 0.71 | APP (0.62) | APPKDM4EHTR6PDE5A | |
| SCHEMBL3300276 | 0.70 | PNMT (0.65) | CYP3A4PNMT |
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-109641886-A | bicyclic BET bromodomain inhibitors and uses thereof | 康威基内有限公司 | 2019-04-16 | — | — | CN | disclosed |