Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.55 |
| ▸ | ABL1 | P00519 | 8/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30761187 | 0.88 | GRM5 (0.60) | GRM5CYP1A2CYP2C9KCNH2CYP3A4 | |
| SCHEMBL30761151 | 0.86 | GRM5 (0.50) | GRM5ABL1CYP1A2CYP2C9KCNH2 | |
| SCHEMBL30761114 | 0.85 | GRM5 (0.49) | GRM5ABL1CYP1A2CYP2C9KCNH2 | |
| SCHEMBL31318893 | 0.84 | ABL1 (0.51) | GRM5ABL1 | |
| SCHEMBL31318873 | 0.83 | CYP3A4 (0.55) | GRM5ABL1CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL29236193 | 0.82 | KDM4E (0.50) | GRM5ABL1CYP3A4 | |
| SCHEMBL31027181 | 0.82 | KDM4E (0.50) | GRM5ABL1CYP3A4 | |
| SCHEMBL30300046 | 0.81 | ABL1 (0.44) | GRM5ABL1 | |
| SCHEMBL30761195 | 0.81 | GRM5 (0.52) | GRM5ABL1CYP1A2CYP2C9KCNH2 | |
| SCHEMBL30761217 | 0.81 | GRM5 (0.52) | GRM5CYP1A2CYP2C9KCNH2CYP3A4 |
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-2024059204-A1 | HETEROARYL ANALOGS AS MGLU5 NEGATIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING THE SAME | VANDERBILT UNIVERSITY (US) | 2024-03-21 | — | — | WO | disclosed |