Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 4/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | MDH1 | P40925 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL9037842 | 0.90 | PARP1 (0.47) | AVPR1AGFERHDAC1HDAC6HTT | |
| SCHEMBL9038924 | 0.89 | ADRA2A (0.49) | AVPR1AGFERHDAC1HDAC6HTT | |
| SCHEMBL9037637 | 0.86 | GFER (0.56) | AVPR1AGFERHDAC1HDAC6HTT | |
| SCHEMBL9037247 | 0.86 | AVPR1A (0.43) | AVPR1AGFERHTTMAPK14NPSR1 | |
| SCHEMBL8923783 | 0.82 | GFER (0.42) | AVPR1AGFERHDAC1HDAC6HTT | |
| SCHEMBL9038015 | 0.82 | ALDH1A1 (0.47) | GFERHDAC1HDAC6HTTNPSR1 | |
| Hydrochloric Acid SCHEMBL9001495 | 0.81 | ALDH1A1 (0.46) | GFERHDAC1HDAC6HTTNPSR1 | |
| SCHEMBL8985883 | 0.81 | ALDH1A1 (0.50) | GFERNPSR1KDRDRD2DRD3 | |
| Hydrochloric Acid SCHEMBL8985797 | 0.80 | ALDH1A1 (0.49) | GFERNPSR1KDRDRD2DRD3 | |
| SCHEMBL9037405 | 0.80 | ADRA2A (0.48) | AVPR1AGFERHDAC1HDAC6HTT |
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 |