Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.43 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL845099 | 0.96 | ITGB1 (0.44) | ITGB1ITGA4GLATSHRHDAC1 | |
| SCHEMBL845351 | 0.89 | ITGB1 (0.41) | ITGB1ITGA4POLBMAPTKMT2A | |
| SCHEMBL872553 | 0.87 | ITGB1 (0.39) | ITGB1ITGA4GLATSHRHDAC1 | |
| SCHEMBL845097 | 0.85 | NAMPT (0.39) | ITGB1ITGA4LMNAKDM4EPOLB | |
| SCHEMBL845622 | 0.84 | ITGB1 (0.42) | ITGB1ITGA4POLBALDH1A1HTT | |
| SCHEMBL845086 | 0.83 | EPHX2 (0.40) | ITGB1ITGA4KDM4EMAPTHPGD | |
| SCHEMBL845214 | 0.81 | ITGB1 (0.39) | ITGB1ITGA4LMNAKDM4EMAPT | |
| SCHEMBL844923 | 0.79 | ALDH1A1 (0.43) | ITGB1ITGA4GLALMNAKDM4E | |
| SCHEMBL845190 | 0.79 | EPHX2 (0.42) | ITGB1ITGA4HPGDMAPK1KMT2A | |
| SCHEMBL845334 | 0.77 | ITGB1 (0.39) | ITGB1ITGA4HDAC1POLBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| 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 |