Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3227705 | 0.82 | SIGMAR1 (0.41) | GAAMAPTMPOHRH4SIGMAR1 | |
| SCHEMBL3227714 | 0.82 | SIGMAR1 (0.41) | GAAMAPTMPOHRH4SIGMAR1 | |
| SCHEMBL1109904 | 0.78 | SMN1; SMN2 (0.36) | KMT2AALDH1A1 | |
| SCHEMBL1109826 | 0.77 | CCNE2 (0.35) | MAPTKMT2AKDM4EALDH1A1HDAC1 | |
| SCHEMBL13093334 | 0.75 | CYP19A1 (0.34) | KMT2AALDH1A1 | |
| SCHEMBL3237488 | 0.75 | CYP3A4 (0.35) | KMT2AALDH1A1 | |
| SCHEMBL1109849 | 0.75 | CYP19A1 (0.34) | KMT2AALDH1A1 | |
| SCHEMBL1109825 | 0.75 | SMN1; SMN2 (0.42) | KDM4EALDH1A1OPRM1OPRK1CHRM2 | |
| SCHEMBL1109848 | 0.71 | KMT2A (0.33) | MAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL1109821 | 0.71 | CYP2D6 (0.42) | MEN1KMT2ABCHEKDM4EALDH1A1 |
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-2008096129-A1 | NITROGEN CONTAINING HETROCYCLIC COMPOUNDS USEFUL AS BIFUNCTIONAL MODULATORS OF M3 RECEPTORS AND BETA- 2 RECEPTORS | ARGENTA DISCOVERY LTD (GB) | 2008-08-14 | — | — | WO | disclosed |