Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.46 |
| ▸ | HAO1 | Q9UJM8 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL402092 | 0.89 | GRM5 (0.50) | GRM5HAO1CYP1A2GRM4 | |
| SCHEMBL23497950 | 0.80 | GRM5 (0.47) | GRM5HAO1FFAR1 | |
| SCHEMBL28277896 | 0.79 | HAO1 (0.44) | GRM5HAO1 | |
| SCHEMBL1105471 | 0.79 | GRM5 (0.53) | GRM5HAO1CYP1A2KCNH2 | |
| SCHEMBL15870932 | 0.77 | GRM5 (0.59) | GRM5HAO1 | |
| SCHEMBL31286309 | 0.77 | GRM5 (0.59) | GRM5HAO1 | |
| SCHEMBL9928719 | 0.75 | NOTUM (0.61) | GRM5CYP1A1CYP1A2CYP1B1KCNH2 | |
| SCHEMBL7873467 | 0.75 | GRM5 (0.44) | GRM5HAO1CYP1A2GRM4 | |
| SCHEMBL4855910 | 0.74 | GRM5 (0.60) | GRM5CYP1A2CYP11B2 | |
| SCHEMBL10131002 | 0.73 | GRM5 (0.54) | GRM5CYP1A1CYP1A2CYP1B1FFAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1214303-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | Merck & Co., Inc. (US) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001016121-A1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | MERCK & CO., INC. (US) | 2001-03-08 | — | — | WO | disclosed |