Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 5/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ATP4A | P20648 | 1/20 | 0.36 |
| ▸ | ATP4B | P51164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7574419 | 0.75 | CHRNB2 (0.46) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8066258 | 0.72 | LTA4H (0.35) | CYP2D6L3MBTL1LMNATSHR | |
| SCHEMBL422229 | 0.70 | CYP2C9 (0.70) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL13976210 | 0.68 | CHRNB2 (0.58) | CHRNB2CHRNA4TDP1LMNA | |
| SCHEMBL20730105 | 0.68 | CHRNB2 (0.64) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4888697 | 0.67 | CHRNB2 (0.62) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL9367178 | 0.67 | CHRNB2 (0.62) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL19055583 | 0.67 | CHRNB2 (0.62) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL30542607 | 0.67 | CHRNB2 (0.62) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL3229561 | 0.67 | CHRNB2 (0.62) | CHRNB2CHRNA4CYP2C9CYP2C19CYP3A4 |
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-1171127-A2 | PHARMACEUTICAL COMPOSITIONS CONTAINING PYRIDINE OR PYRIMIDINE DERIVATIVES FOR INHIBITION OF CYTOKINE PRODUCTION AND SECRETION | Targacept, Inc. (US) | 2002-01-16 | — | — | EP | disclosed |
| WO-2000062767-A2 | PHARMACEUTICAL COMPOSITIONS CONTAINING PYRIDINE OR PYRIMIDINE DERIVATES FOR INHIBITION OF CYTOKINE PRODUCTION AND SECRETION | TARGACEPT, INC. (US) | 2000-10-26 | — | — | WO | disclosed |