Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 3/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.56 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11251579 | 0.87 | CYP2A6 (0.58) | TBXAS1CYP2A6CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL406793 | 0.87 | TBXAS1 (0.59) | TBXAS1CYP2A6CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL11256565 | 0.86 | TBXAS1 (0.55) | TBXAS1 | |
| SCHEMBL11279378 | 0.86 | CYP19A1 (0.65) | TBXAS1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL11253750 | 0.86 | CYP19A1 (0.55) | TBXAS1CYP19A1CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL408821 | 0.86 | TBXAS1 (0.60) | TBXAS1CYP2A6CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL11240853 | 0.86 | TBXAS1 (0.57) | TBXAS1 | |
| Hydrochloric Acid SCHEMBL9996061 | 0.84 | TBXAS1 (0.58) | TBXAS1 | |
| SCHEMBL11281455 | 0.84 | CYP11B1 (0.59) | TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL11240927 | 0.83 | CYP19A1 (0.58) | TBXAS1CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4359475-A | SPERMICIDES, MICROBIOCIDES OR ANTICONVULSANTS | SYNTEX (U.S.A.) INC. (US) | 1982-11-16 | — | — | US | disclosed |
| EP-0064244-A1 | Spermicidal 1-bis(arylalkyl)alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-11-10 | — | — | EP | disclosed |
| US-4321272-A | Derivatives of substituted N-alkylimidazoles | SYNTEX (U.S.A.) INC. (US) | 1982-03-23 | — | — | US | disclosed |
| US-4123542-A | FUNGICIDES, BACTERICIDES, ANTIPROTOZOAL AGENTS | SYNTEX (U.S.A.) INC. (US) | 1978-10-31 | — | — | US | disclosed |