Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7121913 | 1.00 | CHRNB2 (0.40) | CHRNB2CHRNA4DYRK1APTPN1PTPN11 | |
| SCHEMBL7225519 | 0.91 | PTPN1 (0.38) | CHRNB2CHRNA4DYRK1APTPN1PTPN11 | |
| SCHEMBL7181005 | 0.89 | MLLT1 (0.40) | CHRNB2CHRNA4PTPN1ALDH1A1CHRNA7 | |
| SCHEMBL7129660 | 0.89 | CHRNA7 (0.38) | CHRNB2CHRNA4PTPN1KMT2AMEN1 | |
| SCHEMBL7132559 | 0.89 | MLLT1 (0.40) | CHRNB2CHRNA4PTPN1ALDH1A1CHRNA7 | |
| SCHEMBL7117473 | 0.88 | FLT3 (0.37) | CHRNB2CHRNA4PTPN1ALDH1A1HPGD | |
| SCHEMBL7597918 | 0.88 | L3MBTL3 (0.37) | CHRNB2CHRNA4PTPN1KMT2AMEN1 | |
| SCHEMBL7225384 | 0.88 | CHRNB2 (0.40) | CHRNB2CHRNA4KMT2AALDH1A1HPGD | |
| SCHEMBL7124994 | 0.88 | PTPN1 (0.35) | CHRNB2CHRNA4PTPN1KMT2AMEN1 | |
| SCHEMBL7123200 | 0.88 | L3MBTL3 (0.37) | CHRNB2CHRNA4PTPN1KMT2AMEN1 |
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-2002015662-A2 | QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |