Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 4/20 | 0.51 |
| ▸ | DRD5 | P21918 | 3/20 | 0.51 |
| ▸ | DRD2 | P14416 | 3/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16855300 | 0.87 | HRH3 (0.56) | HRH3CYP2D6DRD1DRD5DRD2 | |
| Hydrochloric Acid SCHEMBL16824558 | 0.86 | HRH3 (0.55) | HRH3CYP2D6DRD1DRD5DRD2 | |
| SCHEMBL18186150 | 0.83 | ADRA1A (0.52) | HRH3MEN1KMT2AATMDRD1 | |
| SCHEMBL16846277 | 0.82 | HRH3 (0.56) | HRH3CYP2D6DRD1DRD5DRD2 | |
| SCHEMBL24039956 | 0.81 | HIF1A (0.56) | MEN1KMT2AATMDRD1DRD5 | |
| SCHEMBL11261438 | 0.81 | DRD1 (0.49) | HRH3DRD1DRD5DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL16824528 | 0.81 | HRH3 (0.55) | HRH3CYP2D6DRD1DRD5DRD2 | |
| SCHEMBL15759170 | 0.80 | HRH3 (0.43) | HRH3CYP2D6 | |
| SCHEMBL20220387 | 0.78 | CHRM2 (0.52) | HRH3DRD1DRD2 | |
| SCHEMBL16855353 | 0.78 | STS (0.53) | HRH3MEN1KMT2A |
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-2011116356-A2 | POSITIVE ALLOSTERIC MODULATORS OF GROUP II MGLURS | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2011-09-22 | — | — | WO | disclosed |