Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL479100 | 0.86 | CYP3A4 (0.61) | CYP3A4CRBNTNFRSF1APTGS2 | |
| Water SCHEMBL2484221 | 0.85 | CYP3A4 (0.60) | CYP3A4CRBNTNFRSF1APTGS2 | |
| Water SCHEMBL2908232 | 0.84 | CYP3A4 (0.59) | CYP3A4CRBNTNFRSF1A | |
| SCHEMBL2112795 | 0.82 | CYP3A4 (0.56) | CYP3A4CRBNTNFRSF1A | |
| SCHEMBL2112792 | 0.82 | CYP3A4 (0.56) | CYP3A4CRBNTNFRSF1A | |
| SCHEMBL1530185 | 0.82 | CYP3A4 (0.56) | CYP3A4CRBNKIF11 | |
| SCHEMBL1530182 | 0.82 | CYP3A4 (0.56) | CYP3A4CRBNKIF11 | |
| Abt-072 SCHEMBL479128 | 0.80 | CRBN (0.63) | CYP3A4CRBNTNFRSF1A | |
| Abt-072 SCHEMBL1530682 | 0.80 | CRBN (0.63) | CYP3A4CRBNTNFRSF1A | |
| Abt-072 SCHEMBL479219 | 0.80 | CRBN (0.63) | CYP3A4CRBNTNFRSF1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2222646-A1 | URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C | Abbott Laboratories (US) | 2010-09-01 | — | — | EP | disclosed |
| EP-2203430-A1 | N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS | Abbott Laboratories (US) | 2010-07-07 | — | — | EP | disclosed |
| WO-2009039127-A1 | URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C | ABBOTT LABORATORIES (US) | 2009-03-26 | — | — | WO | disclosed |
| WO-2009039135-A1 | N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS | ABBOTT LABORATORIES (US) | 2009-03-26 | — | — | WO | disclosed |