Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.38 |
| ▸ | OXER1 | Q8TDS5 | 5/20 | 0.37 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL14387043 | 0.82 | KCNH2 (0.43) | KCNH2OXER1NPC1POLBMAPT | |
| SCHEMBL5365143 | 0.79 | ALDH1A1 (0.42) | KCNH2OXER1CYSLTR2CYSLTR1ALDH1A1 | |
| SCHEMBL14386717 | 0.77 | CCR2 (0.43) | KCNH2NPC1ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL14386995 | 0.73 | OXER1 (0.54) | HTR4OXER1 | |
| SCHEMBL8801615 | 0.70 | HTR4 (0.37) | HTR4OXER1CNR2 | |
| SCHEMBL17509621 | 0.68 | KCNH2 (0.49) | KCNH2CYSLTR2CYSLTR1NPC1MAPT | |
| SCHEMBL5886619 | 0.67 | KCNH2 (0.47) | KCNH2NPC1MAPTRAB9A | |
| SCHEMBL6371432 | 0.66 | KCNH2 (0.58) | KCNH2CYSLTR2CYSLTR1MAPTALDH1A1 | |
| SCHEMBL16151309 | 0.66 | KCNH2 (0.46) | KCNH2NPC1MAPTRAB9ACYP3A4 | |
| SCHEMBL21323507 | 0.66 | POLB (0.40) | HTR4OXER1POLBMAPTALDH1A1 |
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-2007134421-A1 | 2-VINYL INDOLES, PYRIDO AND AZEPINO INDOLE DERIVATIVES, 2-ALKYNYL INDOLES, 2-ALKYNYL BENZO[b]FURANS, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF | LAUTENS MARK (CA) | 2007-11-29 | — | — | WO | disclosed |
| WO-2007134421-A1 | 2-VINYL INDOLES, PYRIDO AND AZEPINO INDOLE DERIVATIVES, 2-ALKYNYL INDOLES, 2-ALKYNYL BENZO[b]FURANS, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF | LAUTENS MARK (CA) | 2007-11-29 | — | — | WO | disclosed |