Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | VNN1 | O95497 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL845375 | 0.89 | MAPK1 (0.46) | ALDH1A1MEN1KMT2AKDM4EATM | |
| SCHEMBL845431 | 0.88 | TRPV1 (0.43) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL845376 | 0.87 | ALDH1A1 (0.44) | ALDH1A1VNN1MEN1KMT2AKDM4E | |
| SCHEMBL845401 | 0.87 | ALDH1A1 (0.45) | ALDH1A1VNN1MEN1KMT2AKDM4E | |
| SCHEMBL845007 | 0.86 | PABPC1 (0.49) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL845131 | 0.86 | PABPC1 (0.49) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL845191 | 0.86 | HRH3 (0.52) | ALDH1A1VNN1KDM4ELMNAFKBP1A | |
| SCHEMBL845712 | 0.85 | HRH3 (0.50) | ALDH1A1KDM4ELMNAPAX8HRH3 | |
| SCHEMBL845534 | 0.85 | HRH3 (0.43) | ALDH1A1VNN1KMT2AKDM4ELMNA | |
| SCHEMBL845484 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2AKDM4ELMNA |
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-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |
| EP-1893573-B1 | INHIBITORS OF HCV REPLICATION | BRISTOL MYERS SQUIBB CO (US) | 2010-07-21 | — | — | EP | disclosed |