Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 11/20 | 0.62 |
| ▸ | DBF4 | Q9UBU7 | 11/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL289783 | 0.99 | CDC7 (0.61) | CDC7DBF4KDM4EALDH1A1CYP3A4 | |
| SCHEMBL2881465 | 0.90 | CDC7 (0.72) | CDC7DBF4KDM4EALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL6201525 | 0.89 | CDC7 (0.70) | CDC7DBF4KDM4EALDH1A1CYP3A4 | |
| SCHEMBL289506 | 0.88 | CDC7 (0.62) | CDC7DBF4KDM4EALDH1A1LMNA | |
| SCHEMBL289156 | 0.88 | ALDH1A1 (0.65) | CDC7DBF4KDM4EALDH1A1LMNA | |
| SCHEMBL289730 | 0.87 | CDC7 (0.79) | CDC7DBF4KDM4EALDH1A1LMNA | |
| SCHEMBL290101 | 0.87 | ALDH1A1 (0.64) | CDC7DBF4KDM4EALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL289729 | 0.86 | CDC7 (0.77) | CDC7DBF4KDM4EALDH1A1LMNA | |
| SCHEMBL289879 | 0.84 | CYP3A4 (0.62) | KDM4EALDH1A1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL289321 | 0.84 | CYP3A4 (0.62) | CDC7DBF4KDM4EALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427447-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | Pike Pharma GmbH (CH) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128163-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | PIKE PHARMA GMBH (CH) | 2010-11-11 | — | — | WO | disclosed |