Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNA2 | Q15822 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.35 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | PTGES | O14684 | 1/20 | 0.31 |
| ▸ | LSS | P48449 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.30 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774742 | 1.00 | CHRNB2 (0.36) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774441 | 0.91 | SPHK1 (0.36) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774450 | 0.91 | SPHK1 (0.36) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774495 | 0.89 | SPHK1 (0.42) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774503 | 0.89 | SPHK1 (0.42) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774780 | 0.88 | SPHK1 (0.46) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774791 | 0.88 | SPHK1 (0.46) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9156772 | 0.83 | FFAR1 (0.39) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9156767 | 0.83 | FFAR1 (0.39) | CHRNB2CHRNA2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8774056 | 0.81 | DRD2 (0.38) | EGLN1DRD2LSS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |