Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CDK8 | P49336 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PTPRC | P08575 | 1/20 | 0.43 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.42 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2474844 | 0.84 | HPGD (0.70) | HPGDPTGS1ATMNPSR1CYP1A2 | |
| SCHEMBL1752766 | 0.74 | HPGD (0.57) | HPGDPTGS1ATMNPSR1CYP1A2 | |
| SCHEMBL11144936 | 0.73 | HPGD (0.64) | HPGDPTGS1ATMNPSR1CDK8 | |
| SCHEMBL1550943 | 0.73 | HPGD (1.00) | HPGDPTGS1ATMNPSR1CYP1A2 | |
| SCHEMBL8898020 | 0.73 | HPGD (0.64) | HPGDPTGS1ATMNPSR1CDK8 | |
| SCHEMBL10288495 | 0.73 | HPGD (0.64) | HPGDPTGS1ATMNPSR1CYP1A2 | |
| SCHEMBL701571 | 0.73 | HPGD (0.64) | HPGDADORA2APTGS1ATMNPSR1 | |
| SCHEMBL9251834 | 0.72 | ATM (0.64) | ADORA2AATMNPSR1KDM4EALDH1A1 | |
| SCHEMBL31014291 | 0.72 | ATM (0.64) | ADORA2AATMNPSR1KDM4EALDH1A1 | |
| SCHEMBL3946521 | 0.72 | HPGD (0.54) | HPGDPTGS1ATMNPSR1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008019266-A2 | ACYCLIC, PYRIDAZINONE-DERIVED HEPATITIS C SERINE PROTEASE INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |