Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22455050 | 0.80 | AR (0.47) | ARHSD11B1 | |
| SCHEMBL1033628 | 0.77 | AR (0.42) | AR | |
| SCHEMBL9893026 | 0.77 | CNR1 (0.46) | CNR1CNR2ARMEN1KMT2A | |
| SCHEMBL2572245 | 0.76 | CNR1 (0.53) | CNR1CNR2MEN1KMT2AHSD11B1 | |
| SCHEMBL2572244 | 0.76 | CNR1 (0.53) | CNR1CNR2MEN1KMT2AHSD11B1 | |
| SCHEMBL26607916 | 0.74 | AR (0.43) | ARMEN1KMT2ASIGMAR1HSD11B1 | |
| Ammonia Solution, Strong SCHEMBL28797344 | 0.74 | ALDH1A1 (0.44) | ARMEN1KMT2ASIGMAR1 | |
| SCHEMBL27720444 | 0.74 | ALDH1A1 (0.53) | MEN1KMT2AHTR3EHTR3BADRB1 | |
| SCHEMBL4487460 | 0.73 | ADRB1 (0.50) | ELANEMEN1KMT2AHTR3EHTR3B | |
| SCHEMBL20224854 | 0.72 | HTR3E (0.49) | HTR3EHTR3BADRB1HTR3AHTR3D |
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-8629157-B2 | Pyrrolidine compounds which modulate the CB2 receptor | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-01-14 | — | — | US | disclosed |