Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.51 |
| ▸ | IDO1 | P14902 | 2/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29669854 | 0.85 | ADRA2C (0.59) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL6956296 | 0.85 | ADRA2C (0.59) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL6299467 | 0.85 | ADRA2C (0.59) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL6312563 | 0.85 | CYP19A1 (0.45) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL9374363 | 0.80 | CYP19A1 (0.60) | CYP19A1CYP11B1CYP11B2IDO1 | |
| SCHEMBL11699486 | 0.79 | CYP3A4 (0.51) | CYP19A1IDO1ADRA2CCYP2C9CYP3A4 | |
| SCHEMBL11635113 | 0.77 | CYP19A1 (0.55) | CYP19A1CYP11B1CYP11B2ADRA2CCYP3A4 | |
| SCHEMBL11696508 | 0.77 | IDO1 (0.72) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL11701202 | 0.77 | CYP19A1 (0.59) | CYP19A1CYP11B1CYP11B2IDO1ADRA2C | |
| SCHEMBL11702330 | 0.76 | CYP2C9 (0.53) | CYP19A1IDO1ADRA2CCYP2C9CYP3A4 |
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-4055652-A | 1-[β(R-thio)phenethyl]imidazoles and derivatives thereof | SYNTEX (U.S.A.) INC. (US) | 1977-10-25 | — | — | US | disclosed |