Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 4/20 | 0.55 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | ADH5 | P11766 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7068530 | 0.90 | NAAA (0.63) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL9368933 | 0.89 | CYP3A4 (0.63) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL9363661 | 0.87 | ALDH1A1 (0.58) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL8781065 | 0.86 | CYP4Z1 (0.57) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| Hydrochloric Acid SCHEMBL9363955 | 0.86 | BLM (0.59) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL9363643 | 0.85 | DRD3 (0.51) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| Hydrochloric Acid SCHEMBL8781047 | 0.85 | CYP4Z1 (0.56) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL9363630 | 0.85 | DRD3 (0.55) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| Hydrochloric Acid SCHEMBL9364164 | 0.84 | DRD3 (0.54) | CYP3A4BAZ2BHTTCYP4Z1DRD3 | |
| SCHEMBL9369002 | 0.83 | TDP1 (0.52) | CYP3A4BAZ2BHTTCYP4Z1DRD3 |
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-1885697-A2 | SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006121719-A2 | SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME | BOEHRINGER INGELHEIM INTERNATIONAL, GMBH (DE) | 2006-11-16 | — | — | WO | disclosed |