Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL28052756 | 0.81 | ADRA2A (0.50) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL6205158 | 0.77 | ADRA2A (0.55) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL7803293 | 0.73 | ALDH1A1 (0.50) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL177279 | 0.72 | ALDH1A1 (0.55) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL19342150 | 0.71 | ALDH1A1 (0.66) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL16452439 | 0.71 | ALDH1A1 (0.50) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL11323988 | 0.71 | ALDH1A1 (0.53) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL8022161 | 0.71 | SLC6A4 (0.50) | ADRA2AADRA2BADRA2CALDH1A1HPGD | |
| SCHEMBL4888000 | 0.70 | ALDH1A1 (0.69) | ALDH1A1HPGDHTTSMN1; SMN2PTGDR2 | |
| SCHEMBL11673199 | 0.70 | ALDH1A1 (0.53) | ADRA2AADRA2BADRA2CALDH1A1HPGD |
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-1071670-A1 | NOVEL DIPHENYL-SUBSTITUTED 5-RING-HETEROCYCLES, METHOD FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM KG (DE) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999054314-A1 | NOVEL DIPHENYL-SUBSTITUTED 5-RING-HETEROCYCLES, METHOD FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-10-28 | — | — | WO | disclosed |