Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6802348 | 0.85 | LMNA (0.56) | ADRA2AADRA2BADRA2CGAAMAPT | |
| SCHEMBL2728866 | 0.85 | CYP1A2 (0.49) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL2728868 | 0.85 | CYP1A2 (0.49) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL22557298 | 0.84 | ADRA2A (0.49) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL28900871 | 0.83 | ADRA2A (0.47) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL29966397 | 0.83 | ADRA2A (0.48) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL12526403 | 0.83 | ADRA2A (0.48) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL14547957 | 0.80 | CYP2C19 (0.55) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL30189836 | 0.80 | CYP2C19 (0.55) | ADRA2AADRA2BADRA2CGAACYP1A2 | |
| SCHEMBL31456058 | 0.79 | LOXL2 (0.52) | ADRA2AADRA2BADRA2CGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170191986-A1 | Compounds and Method of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators | HMI Medical Innovations, LLC | 2017-07-06 | — | — | US | disclosed |