Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.51 |
| ▸ | SYK | P43405 | 1/20 | 0.49 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | PBK | Q96KB5 | 5/20 | 0.45 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | SETD2 | Q9BYW2 | 1/20 | 0.43 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | GHSR | Q92847 | 2/20 | 0.41 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL4558311 | 0.93 | HRH4 (0.53) | HRH4SYKSMYD3PBKNSD2 | |
| SCHEMBL3604185 | 0.89 | SMYD3 (0.47) | HRH4SYKSMYD3MAPK1OPRK1 | |
| SCHEMBL3604188 | 0.89 | SMYD3 (0.47) | HRH4SYKSMYD3MAPK1OPRK1 | |
| SCHEMBL25532114 | 0.84 | MAPK1 (0.47) | SYKSMYD3MAPK1OPRK1PBK | |
| SCHEMBL3610802 | 0.83 | SMYD3 (0.67) | HRH4SYKSMYD3MAPK1OPRK1 | |
| SCHEMBL3610798 | 0.83 | SMYD3 (0.67) | HRH4SYKSMYD3MAPK1OPRK1 | |
| SCHEMBL3610639 | 0.81 | SYK (0.51) | SYKSMYD3MAPK1OPRK1PBK | |
| SCHEMBL3610636 | 0.81 | SYK (0.51) | SYKSMYD3MAPK1OPRK1PBK | |
| SCHEMBL3618497 | 0.81 | SYK (0.51) | SYKSMYD3MAPK1OPRK1PBK | |
| SCHEMBL21225379 | 0.80 | SYK (0.49) | SYKMAPK1OPRK1PBKCDK2AP1 |
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-2009158375-A1 | AZA-CYLIC INDOLE- 2 -CARBOXAMIDES AND METHODS OF USE THEREOF | ABBOTT LABORATORIES (US) | 2009-12-30 | — | — | WO | claimed |