Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | QDPR | P09417 | 2/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 4/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30469414 | 1.00 | ADRA1A (0.39) | ADRA1AADRA1BPOLBSIGMAR1HTR2C | |
| SCHEMBL4294398 | 0.72 | SCN9A (0.39) | SIGMAR1HTR2CQDPRCDK9 | |
| SCHEMBL4004663 | 0.72 | SIGMAR1 (0.47) | SIGMAR1HTR2CQDPRHTR6GRM5 | |
| SCHEMBL30617923 | 0.71 | TDP1 (0.41) | ADRA1AADRA1BPOLBKDM4ETDP1 | |
| SCHEMBL31652073 | 0.71 | CCNT1 (0.50) | SIGMAR1HTR2CQDPRCDK9CCNT1 | |
| Trifluoroacetic Acid SCHEMBL3854727 | 0.70 | TRPV1 (0.40) | SIGMAR1HTR2C | |
| SCHEMBL2428360 | 0.70 | GRM5 (0.57) | POLBGRM5GRM1 | |
| SCHEMBL13228917 | 0.69 | CDK9 (0.47) | SIGMAR1HTR2CQDPRGRM5KDM4E | |
| SCHEMBL4004617 | 0.69 | SIGMAR1 (0.49) | SIGMAR1HTR2CQDPRHTR6GRM5 | |
| SCHEMBL7454398 | 0.69 | SIGMAR1 (0.47) | SIGMAR1HTR2CQDPRGRM5CDK9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003101994-A1 | FUSED BICYCLIC AROMATIC COMPOUNDS THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION | ABBOTT LABORATORIES (US) | 2003-12-11 | — | — | WO | disclosed |