Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.81 |
| ▸ | MLYCD | O95822 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PTGIR | P43119 | 1/20 | 0.46 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7751510 | 0.85 | ADRA2C (0.69) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL4168860 | 0.83 | ADRA2C (0.67) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL28827956 | 0.82 | ADRA2C (0.66) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL9001626 | 0.81 | ADRA2C (0.65) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL1491953 | 0.81 | ADRA2C (0.65) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL4910960 | 0.81 | ADRA2C (0.65) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL4826849 | 0.81 | ADRA2C (0.65) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL5742511 | 0.81 | ADRA2C (0.54) | ADRA2CALDH1A1POLBHTTMEN1 | |
| SCHEMBL4161794 | 0.80 | ADRA2C (0.73) | ADRA2CMLYCDACHEALDH1A1POLB | |
| SCHEMBL10460057 | 0.79 | ADRA2C (0.53) | ADRA2CACHEALDH1A1HTTLTB4R2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4243585-A | Bendodiazocine derivatives and process of making the same | KALI-CHEMIE AKTIENGESELLSCHAFT (DE) | 1981-01-06 | — | — | US | disclosed |