Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 3/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 2/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.39 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28615047 | 0.89 | ANPEP (0.44) | MAOAMAOBHTR2ACES1IDO1 | |
| SCHEMBL3488301 | 0.75 | FAAH (0.50) | MAOAMAOBFAAHCES1S1PR2 | |
| SCHEMBL5789705 | 0.74 | MAOA (0.54) | GRIK1MAOAMAOBHTR2AIDO1 | |
| SCHEMBL3266047 | 0.74 | S1PR2 (0.59) | GRIK1MAOAMAOBHTR2AIDO1 | |
| SCHEMBL5807580 | 0.74 | GRIK1 (0.46) | GRIK1MAOAMAOBHTR2AFAAH | |
| SCHEMBL7953179 | 0.73 | ANPEP (0.47) | MAOAMAOBHTR2AIDO1ANPEP | |
| Hydrochloric Acid SCHEMBL10535805 | 0.72 | MAOB (0.54) | GRIK1MAOAMAOBHTR2AIDO1 | |
| Hydrochloric Acid SCHEMBL1979100 | 0.72 | S1PR2 (0.57) | GRIK1MAOAMAOBHTR2AIDO1 | |
| SCHEMBL14544283 | 0.71 | GRIK1 (0.54) | GRIK1MAOAMAOBHTR2AIDO1 | |
| SCHEMBL3712834 | 0.71 | SLC6A2 (0.56) | GRIK1MAOAMAOBHTR2ASIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107949562-B | Positive allosteric modulators of muscarinic M2 receptors | 拜耳制药股份公司 | 2021-07-23 | — | — | CN | disclosed |