Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 2/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 3/20 | 0.43 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5544627 | 0.82 | NPC1 (0.53) | CTRB1CYP1A2CYP2C9CYP2C19NPC1 | |
| SCHEMBL6358804 | 0.79 | L3MBTL1 (0.46) | CYP1A2CYP2C19NPC1RAB9APSMB5 | |
| SCHEMBL9782008 | 0.79 | TSHR (0.48) | CTRB1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL11076699 | 0.78 | NPC1 (0.49) | CTRB1CYP1A2NPC1RAB9ALMNA | |
| SCHEMBL7926361 | 0.77 | CTSS (0.42) | SLC1A3SLC1A2SLC1A1CYP1A2MEN1 | |
| SCHEMBL4769827 | 0.77 | MMP9 (0.48) | SLC1A3SLC1A2SLC1A1CYP1A2MEN1 | |
| SCHEMBL717757 | 0.76 | SLC1A3 (0.46) | CTRB1SLC1A3SLC1A2SLC1A1CYP1A2 | |
| SCHEMBL24111516 | 0.75 | TACR1 (0.66) | CTRB1CYP2C9CYP2C19TACR1ALDH1A1 | |
| SCHEMBL14927646 | 0.74 | CTRB1 (0.61) | CTRB1NPC1RAB9ATACR1ALDH1A1 | |
| SCHEMBL20551984 | 0.73 | PSMB5 (0.47) | SLC1A3SLC1A2SLC1A1CYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2170050-A1 | SHORT ACTING PHENYLALKYLAMINE CALCIUM CHANNEL BLOCKERS AND USES THEREOF | Milestone Pharmaceuticals Inc. (CA) | 2010-04-07 | — | — | EP | disclosed |
| WO-2008156820-A1 | SHORT ACTING PHENYLALKYLAMINE CALCIUM CHANNEL BLOCKERS AND USES THEREOF | MILESTONE PHARMACEUTICALS INC. (CA) | 2008-12-24 | — | — | WO | disclosed |