Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.33 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.32 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769797 | 1.00 | PDE4A (0.37) | PDE4AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4769434 | 0.88 | PARG (0.36) | PDE4AMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL4769440 | 0.88 | PARG (0.36) | PDE4AMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL4762557 | 0.87 | KMT2A (0.40) | PDE4AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4762556 | 0.87 | KMT2A (0.40) | PDE4AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4767470 | 0.86 | NPC1 (0.41) | MEN1KMT2AKDM4EALDH1A1MAPT | |
| SCHEMBL4767463 | 0.86 | NPC1 (0.41) | MEN1KMT2AKDM4EALDH1A1MAPT | |
| SCHEMBL4866193 | 0.84 | PDE4A (0.39) | PDE4AMEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL4763924 | 0.84 | NPSR1 (0.33) | PDE4AALDH1A1MAPTCYP3A4CYP2D6 | |
| SCHEMBL4763921 | 0.84 | NPSR1 (0.33) | PDE4AALDH1A1MAPTCYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |