Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12826165 | 1.00 | SHBG (0.43) | SHBGEPHX1TP53KDM4EGMNN | |
| SCHEMBL13351528 | 0.80 | EPHX1 (0.52) | SHBGEPHX1TP53KDM4EALDH1A1 | |
| SCHEMBL27984541 | 0.77 | SHBG (0.41) | SHBGEPHX1KDM4EALDH1A1EPHX2 | |
| SCHEMBL12600769 | 0.77 | DPP4 (0.46) | SHBGEPHX1ALDH1A1 | |
| SCHEMBL26870367 | 0.76 | SHBG (0.39) | SHBGEPHX1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL31547019 | 0.76 | SHBG (0.39) | SHBGEPHX1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL8162922 | 0.75 | TSHR (0.40) | SHBGEPHX1TP53KDM4ESMN1; SMN2 | |
| SCHEMBL2256208 | 0.75 | ALDH1A1 (0.53) | SHBGKDM4EALDH1A1 | |
| SCHEMBL12071026 | 0.75 | EPHX1 (0.44) | EPHX1TP53KDM4EGMNNLMNA | |
| SCHEMBL8277386 | 0.75 | EPHX1 (0.44) | EPHX1TP53KDM4EGMNNLMNA |
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-2015005901-A1 | COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-01-15 | — | — | WO | disclosed |
| WO-2013106520-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2013-07-18 | — | — | WO | disclosed |