Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.43 |
| ▸ | ANPEP | P15144 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL9257868 | 0.84 | NOS3 (0.41) | MAOAMAOBPLAUANPEP | |
| SCHEMBL2725956 | 0.79 | CYP1A2 (0.51) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL691835 | 0.79 | PLAU (0.50) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL9125425 | 0.72 | PLAU (0.43) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL7879944 | 0.71 | PLAU (0.45) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL5693079 | 0.70 | PLAU (0.60) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL388174 | 0.69 | PLAU (0.58) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL24701721 | 0.67 | PLAU (0.56) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL6951241 | 0.67 | ANPEP (0.57) | MAOAMAOBPLAUMTNR1AMTNR1B | |
| SCHEMBL17151026 | 0.67 | PLAU (0.56) | MAOAMAOBPLAUMTNR1AMTNR1B |
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-3183242-B1 | SUBSTITUTED BICYCLIC COMPOUNDS | BRISTOL MYERS SQUIBB CO (US) | 2021-05-19 | — | — | EP | disclosed |
| US-5475113-A | Treatment of skin disorders, skin cancer | ALLERGAN, INC. (US) | 1995-12-12 | — | — | US | disclosed |