Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | MDH1 | P40925 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | AVPR1A | P37288 | 4/20 | 0.41 |
| ▸ | SSTR2 | P30874 | 7/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9038924 | 0.91 | ADRA2A (0.49) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9036880 | 0.87 | ADRA2A (0.49) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9037304 | 0.85 | ADRA2A (0.51) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9037017 | 0.85 | ADRA2A (0.50) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9037801 | 0.84 | GFER (0.55) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9038780 | 0.84 | ADRA2A (0.49) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9038099 | 0.84 | ADRA2A (0.49) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9035802 | 0.83 | ADRA2A (0.49) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL8795126 | 0.83 | ADRA2A (0.48) | ADRA2AADORA3CHRM1MAOATBXA2R | |
| SCHEMBL9037435 | 0.81 | ADRA2A (0.50) | ADRA2AADORA3CHRM1MAOATBXA2R |
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 |
|---|---|---|---|---|---|---|---|
| EP-0507861-B1 | DIAROMATIC SUBSTITUTED ANTI-AIDS COMPOUNDS | UPJOHN CO (US) | 1996-09-11 | — | — | EP | claimed |
| WO-1991009849-A1 | DIAROMATIC SUBSTITUTED ANTI-AIDS COMPOUNDS | THE UPJOHN COMPANY (US) | 1991-07-11 | — | — | WO | claimed |