Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | CTSA | P10619 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 3/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1573515 | 1.00 | CYP2C19 (0.54) | CYP2C19HIF1ACTSAAKT1CA12 | |
| SCHEMBL31477659 | 1.00 | CYP2C19 (0.54) | CYP2C19HIF1ACTSAAKT1CA12 | |
| SCHEMBL4044110 | 0.90 | CYP2C19 (0.46) | CYP2C19HIF1ACTSAAKT1CA12 | |
| SCHEMBL6513375 | 0.87 | HIF1A (0.39) | CYP2C19HIF1ACTSAAKT1CA12 | |
| SCHEMBL5862815 | 0.87 | MIF (0.49) | CYP2C19HIF1ACTSACYP1A2MEN1 | |
| SCHEMBL29770797 | 0.86 | CA12 (0.44) | CYP2C19HIF1AAKT1CA12CA1 | |
| SCHEMBL5860841 | 0.85 | ITGB1 (0.47) | CYP2C19HIF1ACA1RECQLMAPK1 | |
| SCHEMBL5634375 | 0.85 | CTSS (0.43) | CYP2C19HIF1ACTSAAKT1CA12 | |
| SCHEMBL6517072 | 0.82 | ALDH1A1 (0.48) | RECQLMAPK1NPC1RAB9A | |
| SCHEMBL3375626 | 0.82 | MAPT (0.42) | CYP2C19HIF1AAKT1CA12CA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7041667-B1 | CCR5 modulators | PFIZER, INC. (US) | 2006-05-09 | — | — | US | disclosed |