Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC2 | Q92887 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 10/20 | 0.43 |
| ▸ | CNR1 | P21554 | 4/20 | 0.43 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL5353392 | 1.00 | ABCC2 (0.43) | ABCC2CNR2CNR1PSEN1PSEN2 | |
| SCHEMBL5359096 | 0.84 | CCR2 (0.49) | ALDH1A1KDM4EHTTL3MBTL1NR1H2 | |
| SCHEMBL5363418 | 0.84 | CCR2 (0.49) | ALDH1A1KDM4EHTTL3MBTL1NR1H2 | |
| SCHEMBL5352515 | 0.80 | THRB (0.38) | ALDH1A1KDM4EHTTNR1H2MTNR1A | |
| SCHEMBL5352513 | 0.80 | THRB (0.38) | ALDH1A1KDM4EHTTNR1H2MTNR1A | |
| SCHEMBL23944952 | 0.79 | ALDH1A1 (0.41) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL2239999 | 0.79 | KDM4E (0.42) | ALDH1A1KDM4EHTTL3MBTL1NR1H2 | |
| SCHEMBL16264927 | 0.78 | CNR2 (0.54) | CNR2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5352328 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HTTNR1H2 | |
| SCHEMBL5352324 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HTTNR1H2 |
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 1 patent. 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 |