Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 4/20 | 0.53 |
| ▸ | CFD | P00746 | 2/20 | 0.49 |
| ▸ | GFER | P55789 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2195379 | 0.84 | HSD11B1 (0.49) | HSD11B1CFDGFERALDH1A1HCRTR1 | |
| SCHEMBL845332 | 0.84 | NPC1 (0.52) | CFDALDH1A1CNR1CNR2TRPV1 | |
| SCHEMBL845008 | 0.82 | ALDH1A1 (0.54) | ALDH1A1POLBCYP2C9CYP2C19CYP1A2 | |
| SCHEMBL845039 | 0.82 | TRPV1 (0.51) | ALDH1A1HCRTR1TRPV1CYP2C9CYP2C19 | |
| SCHEMBL844996 | 0.81 | CYP2C9 (0.50) | ALDH1A1TRPV1CYP2C9CYP2C19MAPK1 | |
| SCHEMBL845284 | 0.81 | MAPK1 (0.58) | ALDH1A1CYP2C9CYP2C19MAPK1HTT | |
| SCHEMBL845131 | 0.80 | PABPC1 (0.49) | ALDH1A1TRPV1CYP2C9CYP2C19MAPK1 | |
| SCHEMBL845350 | 0.80 | MAPK1 (0.49) | ALDH1A1TRPV1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL845007 | 0.80 | PABPC1 (0.49) | ALDH1A1TRPV1CYP2C9CYP2C19MAPK1 | |
| SCHEMBL845443 | 0.79 | CYP2C9 (0.47) | ALDH1A1TRPV1CYP2C9CYP2C19MAPK1 |
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 |