Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL7419580 | 1.00 | HTR2C (0.48) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL10813428 | 0.81 | DRD2 (0.53) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| SCHEMBL29073386 | 0.80 | HDAC8 (0.50) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| SCHEMBL25330315 | 0.78 | CYP19A1 (0.45) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL10812978 | 0.78 | PDE3B (0.42) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| SCHEMBL10262493 | 0.77 | TRPM5 (0.37) | HTR2CCHRNB2CHRNA4HTR2BHTR2A | |
| SCHEMBL7420138 | 0.76 | PNMT (0.45) | HTR2CHTR2BHTR2A | |
| SCHEMBL7420139 | 0.76 | PNMT (0.45) | HTR2CHTR2BHTR2A | |
| SCHEMBL11087883 | 0.76 | PDE3B (0.45) | HTR2CPDE3BPDE3ACHRNB2CHRNB4 | |
| SCHEMBL18325378 | 0.75 | HTR2C (0.50) | HTR2CCHRNB2CHRNB4CHRNA3CHRNA7 |
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-0815103-A1 | TRYPSIN AND THROMBIN INHIBITORS | Novartis AG (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996029327-A1 | TRYPSIN AND THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1996-09-26 | — | — | WO | disclosed |