Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RHOC | P08134 | 1/20 | 0.49 |
| ▸ | RHOA | P61586 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL845438 | 0.89 | RHOC (0.41) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845300 | 0.84 | CYP2C9 (0.54) | RHOCRHOAMAPTCYP2C9CYP2C19 | |
| SCHEMBL844934 | 0.82 | RHOC (0.51) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845568 | 0.81 | RHOC (0.36) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845181 | 0.81 | MAPT (0.69) | MAPTHTTPOLBAPOBEC3AAPOBEC3G | |
| SCHEMBL873200 | 0.80 | RHOC (0.48) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845229 | 0.79 | RHOC (0.48) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845297 | 0.78 | RHOC (0.48) | RHOCRHOAMAPTNPC1CYP2C9 | |
| SCHEMBL845338 | 0.78 | RHOC (0.48) | RHOCRHOANPC1CYP2C9CYP2C19 | |
| SCHEMBL844951 | 0.78 | ROCK2 (0.55) | RHOCRHOAMAPTNPC1CYP2C9 |
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 |