Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HHAT | Q5VTY9 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6072959 | 0.80 | CHRM3 (0.50) | SIGMAR1CHRM3HHATCYP2D6 | |
| SCHEMBL30794420 | 0.75 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2ANPSR1LMNA | |
| SCHEMBL3237239 | 0.75 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2ANPSR1LMNA | |
| SCHEMBL6073004 | 0.72 | CHRM3 (0.52) | CHRM3HHATCYP2D6 | |
| SCHEMBL4080455 | 0.71 | CHRM3 (0.47) | CHRM3 | |
| SCHEMBL8499570 | 0.70 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2ANPSR1LMNA | |
| SCHEMBL5948391 | 0.70 | CHRM3 (0.50) | CHRM3 | |
| SCHEMBL4648949 | 0.69 | PTPN1 (0.45) | ALDH1A1MEN1KMT2ATSHRMAPT | |
| SCHEMBL17117236 | 0.68 | HHAT (0.54) | HHATCYP2D6 | |
| SCHEMBL6072947 | 0.68 | HHAT (0.47) | SIGMAR1CHRM3HHATCYP2D6 |
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-2006035280-A1 | 3,4-DIHYDROISOQUINOLINE COMPOUNDS AS MUSCRINIC RECEPTOR ANTAGONISTS FOR THE TREATMENT OF RESPIRATORY, URINARY AND GASTROINTESTINAL DISEASES | RANBAXY LABORATORIES LIMITED (IN) | 2006-04-06 | — | — | WO | claimed |
| WO-2006035280-A1 | 3,4-DIHYDROISOQUINOLINE COMPOUNDS AS MUSCRINIC RECEPTOR ANTAGONISTS FOR THE TREATMENT OF RESPIRATORY, URINARY AND GASTROINTESTINAL DISEASES | RANBAXY LABORATORIES LIMITED (IN) | 2006-04-06 | — | — | WO | disclosed |