Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3A | Q14432 | 5/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | METAP1 | P53582 | 6/20 | 0.33 |
| ▸ | METAP2 | P50579 | 5/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9669212 | 0.81 | PDE3B (0.44) | PDE3APDE3BPDE4BPDE4APDE4C | |
| SCHEMBL9669163 | 0.79 | CYP19A1 (0.47) | PDE3APDE3BCDK5KDM4ENPC1 | |
| SCHEMBL9670085 | 0.78 | PDE3A (0.40) | PDE3APDE3BPDE4BPDE4APDE4C | |
| SCHEMBL9668854 | 0.76 | PDE3A (0.43) | PDE3APDE3BPDE4BPDE4APDE4C | |
| SCHEMBL9668036 | 0.75 | CTSV (0.41) | PDE3APDE3BCDK5CDK5R1KDM4E | |
| SCHEMBL9669200 | 0.75 | PDE3B (0.42) | PDE3APDE3BPDE4BPDE4APDE4C | |
| SCHEMBL9668089 | 0.73 | CDK5 (0.38) | CDK5CDK5R1IDO1TDO2METAP1 | |
| SCHEMBL10507210 | 0.71 | PDE3B (0.40) | PDE3APDE3BPDE4BPDE4APDE4C | |
| SCHEMBL27805650 | 0.67 | METAP2 (0.54) | IDO1TDO2METAP1METAP2KDM4E | |
| SCHEMBL185088 | 0.62 | PDE4B (0.52) | PDE3APDE3BPDE4BPDE4APDE4C |
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-0223937-B1 | INDOLES SUBSTITUTED WITH HETEROCYCLES, INTERMEDIATES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS | Roche Diagnostics GmbH (DE) | 1992-03-18 | — | — | EP | disclosed |
| US-4851406-A | CARDIOVASCULAR DISORDERS, HYPOTENSIVE | BOEHRINGER MANNHEIM GMBH (DE) | 1989-07-25 | — | — | US | disclosed |