Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 4/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541058 | 1.00 | MEN1 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL938782 | 0.98 | MEN1 (0.51) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL938791 | 0.98 | MEN1 (0.51) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL19156 | 0.98 | MEN1 (0.51) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| Hydrochloric Acid SCHEMBL1764829 | 0.96 | MEN1 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL169110 | 0.92 | CHRNB2 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL6179150 | 0.92 | CHRNB2 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL169111 | 0.92 | CHRNB2 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| Hydrochloric Acid SCHEMBL3335329 | 0.90 | CHRNB2 (0.49) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| Hydrochloric Acid SCHEMBL3335334 | 0.90 | CHRNB2 (0.49) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6093733-A | FOR THE TREATMENT OR PREVENTION OF DISEASES THE TREATMENT OR PREVENTION OF WHICH IS MEDIATED BY MUSCARINIC RECEPTOR AGONISM; ALZHEIMER'S DISEASE | PFIZER INC. | 2000-07-25 | — | — | US | disclosed |
| EP-0705259-B1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-02-25 | — | — | EP | disclosed |
| EP-0705259-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000508-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-01-05 | — | — | WO | disclosed |