Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.70 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.49 |
| ▸ | AGER | Q15109 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29669977 | 1.00 | ADRA2C (0.70) | ADRA2CCYP19A1IDO1HMOX1AGER | |
| SCHEMBL11525306 | 0.88 | ADRA2C (0.63) | ADRA2CCYP19A1IDO1HMOX1 | |
| SCHEMBL9367826 | 0.86 | CYP19A1 (0.57) | ADRA2CCYP19A1IDO1AGER | |
| SCHEMBL29846165 | 0.82 | ADRA2C (1.00) | ADRA2CCYP19A1IDO1 | |
| SCHEMBL4664843 | 0.82 | ADRA2C (1.00) | ADRA2CCYP19A1IDO1 | |
| SCHEMBL4817509 | 0.82 | ADRA2C (1.00) | ADRA2CCYP19A1IDO1 | |
| SCHEMBL30256070 | 0.82 | ADRA2C (1.00) | ADRA2CCYP19A1IDO1 | |
| SCHEMBL4664253 | 0.82 | ADRA2C (1.00) | ADRA2CCYP19A1IDO1 | |
| SCHEMBL11267735 | 0.82 | ADRA2C (0.55) | ADRA2CCYP19A1HMOX1AGER | |
| SCHEMBL6697523 | 0.82 | CYP19A1 (0.53) | ADRA2CCYP19A1IDO1AGER |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109320458-B | Diaryl imidazole-containing compound, preparation method and medical application thereof | 中国药科大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-112694472-A | BuChE-IDO1 inhibitor, preparation method and application thereof | 西南大学 | 2021-04-23 | — | — | CN | disclosed |
| US-4349556-A | Pesticidally active 1-acyloxy-1-phenyl-2-azolyl-ethanes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-09-14 | — | — | US | disclosed |