Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 2/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.49 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 4/20 | 0.48 |
| ▸ | ACHE | P22303 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 5/20 | 0.46 |
| ▸ | MAOA | P21397 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14008053 | 1.00 | NPY5R (0.52) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL14008052 | 1.00 | NPY5R (0.52) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL23099697 | 0.89 | NPY5R (0.47) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL11588617 | 0.84 | ADRA2B (0.61) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL7636285 | 0.82 | NPY5R (0.55) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL7636288 | 0.82 | NPY5R (0.55) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL14008051 | 0.82 | NPY5R (0.55) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL24568139 | 0.82 | NPY5R (0.50) | NPY5RADRA2BHTR2AKCNH2HPGD | |
| SCHEMBL11747268 | 0.81 | NPY5R (0.54) | NPY5RADRA2BADRA2CADRA1AOPRK1 | |
| SCHEMBL11248974 | 0.81 | GAA (0.44) | ADRA2BADRA2CHTR2AKCNH2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5847216-A | Preparation of selegiline | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-12-08 | — | — | US | disclosed |
| EP-0772584-B1 | PROCESS FOR PREPARING SELEGILIN | KNOLL AG (DE) | 1998-06-17 | — | — | EP | disclosed |