Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.53 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.53 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | BCHE | P06276 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21198787 | 0.93 | BCHE (0.58) | CHRNB2CHRNB4CHRNA3CHRNA4BCHE | |
| SCHEMBL21198788 | 0.93 | BCHE (0.58) | CHRNB2CHRNB4CHRNA3CHRNA4BCHE | |
| SCHEMBL28489345 | 0.91 | BCHE (0.57) | CHRNB2CHRNB4CHRNA3CHRNA4BCHE | |
| SCHEMBL28489343 | 0.91 | BCHE (0.57) | CHRNB2CHRNB4CHRNA3CHRNA4BCHE | |
| SCHEMBL1787933 | 0.89 | CHRNB2 (0.50) | CHRNB2CHRNB4CHRNA3CHRNA4DRD2 | |
| Lithium Ion SCHEMBL29789468 | 0.82 | BCHE (0.55) | CHRNB2CHRNB4CHRNA3CHRNA4BCHE | |
| SCHEMBL27741092 | 0.81 | DRD2 (0.50) | CHRNB2CHRNB4CHRNA3CHRNA4DRD2 | |
| SCHEMBL21206426 | 0.79 | BCHE (0.54) | BCHEL3MBTL1TMEM97SIGMAR1 | |
| SCHEMBL28485695 | 0.79 | BCHE (0.54) | BCHEL3MBTL1TMEM97SIGMAR1 | |
| SCHEMBL19779511 | 0.79 | ALDH1A1 (0.63) | DRD2DRD3KCNH2BCHEALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008131859-A2 | USE OF CYCLICALLY SUBSTITUTED FUROPYRIMIDINE DERIVATIVES FOR TREATING PULMONARY ARTERIAL HYPERTONIA | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-11-06 | — | — | WO | disclosed |