Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 1/20 | 0.62 |
| ▸ | ERN1 | O75460 | 1/20 | 0.62 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.62 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.62 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL14198015 | 0.83 | TLR2 (0.70) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL10515793 | 0.82 | NFE2L2 (0.52) | CA12POLBMAPTKDM4ELMNA | |
| SCHEMBL10401043 | 0.81 | TLR2 (0.62) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL5327152 | 0.80 | TLR2 (0.43) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL13457317 | 0.80 | NFE2L2 (0.43) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL4450612 | 0.79 | ERN1 (0.96) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL16004 | 0.77 | ERN1 (1.00) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL60623 | 0.77 | TLR2 (0.67) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL10054715 | 0.77 | TLR2 (0.67) | TLR2ERN1TLR1TLR6CA12 | |
| SCHEMBL11469615 | 0.77 | TLR2 (0.67) | TLR2ERN1TLR1TLR6CA12 |
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 |