Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.35 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR5A | P47898 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8285956 | 0.85 | DRD2 (0.47) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL18664431 | 0.78 | CHRNB2 (0.39) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL13460942 | 0.78 | CHRNB2 (0.39) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL22523926 | 0.77 | DRD2 (0.40) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL29168653 | 0.74 | CHRNB2 (0.36) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL27650139 | 0.73 | CHRNB2 (0.35) | CHRNB2CHRNA4DRD2DRD1SLC6A2 | |
| SCHEMBL28478276 | 0.72 | TSHR (0.44) | CHRNB2CHRNA4DRD2DRD1GFER | |
| SCHEMBL28474805 | 0.72 | TSHR (0.44) | CHRNB2CHRNA4DRD2DRD1GFER | |
| SCHEMBL28473812 | 0.72 | TSHR (0.44) | CHRNB2CHRNA4DRD2DRD1GFER | |
| SCHEMBL1567832 | 0.71 | HTR2A (0.46) | CHRNB2CHRNA4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005032472-A2 | PYRROLIDINE AND PIPERIDINE DERIVATIVES AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-04-14 | — | — | WO | disclosed |
| WO-2004083177-A2 | LINEAR CHAIN SUBSTITUTED MONOCYCLIC AND BICYCLIC DERIVATIVES AS FACTOR XA INHIBITORS | BRYSTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |