Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MOGAT2 | Q3SYC2 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | FAP | Q12884 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8294160 | 0.89 | DRD2 (0.35) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL13896394 | 0.88 | POLB (0.40) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL8278885 | 0.87 | ADRB3 (0.33) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL3968060 | 0.86 | ADRB3 (0.44) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL3968058 | 0.86 | ADRB3 (0.44) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL3968065 | 0.86 | ADRB3 (0.44) | ALDH1A1MAPTTDP1POLBADRB3 | |
| SCHEMBL8278219 | 0.84 | POLB (0.33) | ALDH1A1MAPTTDP1POLBLMNA | |
| SCHEMBL8278256 | 0.83 | REN (0.33) | ADRB3ADRA2BADRA2C | |
| SCHEMBL13886148 | 0.83 | REN (0.33) | ADRB3ADRA2BADRA2C | |
| SCHEMBL3975668 | 0.83 | CTSB (0.37) | ADRB3ADRA2BADRA2CCYP3A4 |
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-2005037214-A2 | MACROCYCLIC CARBOXYLIC ACIDS AND ACYLSULFONAMIDES AS INHIBITORS OF HCV REPLICATION | INTERMUNE, INC. (US) | 2005-04-28 | — | — | WO | disclosed |