Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 3/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP4B1 | P13584 | 2/20 | 0.55 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.55 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.55 |
| ▸ | CYP2A7 | P20853 | 2/20 | 0.55 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.55 |
| ▸ | CYP2F1 | P24903 | 2/20 | 0.55 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP2J2 | P51589 | 2/20 | 0.55 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.55 |
| ▸ | CYP4F8 | P98187 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7946481 | 0.88 | CYP11B1 (0.48) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL8023702 | 0.84 | PDCD1 (0.49) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL7944717 | 0.84 | CYP11B1 (0.45) | CYP1A2CYP2D6CYP2C9CYP2C19PDCD1 | |
| SCHEMBL8017441 | 0.82 | PDCD1 (0.61) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL15719330 | 0.81 | FFAR1 (0.48) | CYP3A4CYP2C8PDCD1CD274CYP11B1 | |
| SCHEMBL3994452 | 0.81 | RAB9A (0.47) | PDCD1CD274CYP11B1CYP11B2ESR2 | |
| SCHEMBL8007347 | 0.81 | AKR1C3 (0.47) | PDCD1CD274CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL3127408 | 0.81 | ALDH1A1 (0.47) | CYP11B1CYP11B2ESR1ESR2APLNR | |
| SCHEMBL6275646 | 0.80 | CYP1A1 (0.59) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 | |
| SCHEMBL17599105 | 0.79 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2CYP2E1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010015653-A1 | PYRIMIDINE DERIVATIVES AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE | SMITHKLINE BEECHAM CORPORATION (US) | 2010-02-11 | — | — | WO | disclosed |
| WO-2009071504-A1 | 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-11 | — | — | WO | disclosed |