Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.37 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.37 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | FNTA | P49354 | 1/20 | 0.35 |
| ▸ | FNTB | P49356 | 1/20 | 0.35 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5377719 | 0.91 | CYP3A4 (0.46) | CYP3A4AKR1B1CAMK2APRMT5WDR77 | |
| SCHEMBL5367073 | 0.91 | CYP3A4 (0.44) | CYP3A4AKR1B1CAMK2APRMT5WDR77 | |
| SCHEMBL5373947 | 0.91 | CYP3A4 (0.44) | CYP3A4AKR1B1PRMT5WDR77CYP2C9 | |
| SCHEMBL5374344 | 0.90 | CYP3A4 (0.43) | CYP3A4AKR1B1CAMK2APRMT5WDR77 | |
| SCHEMBL5373451 | 0.89 | CYP3A4 (0.48) | CYP3A4AKR1B1CAMK2A | |
| SCHEMBL4367667 | 0.89 | CYP3A4 (0.53) | CYP3A4AKR1B1CYP2C9TSHRCYP2C19 | |
| SCHEMBL5369034 | 0.89 | CYP3A4 (0.50) | CYP3A4AKR1B1 | |
| SCHEMBL5369145 | 0.88 | CYP3A4 (0.48) | CYP3A4AKR1B1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5374946 | 0.88 | CYP3A4 (0.42) | CYP3A4AKR1B1CAMK2APRMT5WDR77 | |
| SCHEMBL5382509 | 0.88 | CYP3A4 (0.42) | CYP3A4PRMT5WDR77FNTAFNTB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |
| US-7189718-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-03-13 | — | — | US | disclosed |