Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 2/20 | 0.41 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.40 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | QPCT | Q16769 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10875164 | 0.99 | CYP17A1 (0.49) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL8757551 | 0.87 | CYP19A1 (0.48) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL10876659 | 0.86 | CYP11B1 (0.50) | CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL11076363 | 0.86 | CYP11B1 (0.50) | CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL28857747 | 0.85 | CYP19A1 (0.46) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL11345480 | 0.82 | CYP19A1 (0.46) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL11005198 | 0.82 | CYP19A1 (0.46) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL9441203 | 0.81 | CYP3A4 (0.56) | CYP17A1CYP19A1CYP11B1CYP11B2CYP3A4 | |
| Hydrochloric Acid SCHEMBL11343036 | 0.81 | CYP19A1 (0.44) | CYP17A1CYP19A1CYP11B1CYP11B2POLB | |
| SCHEMBL11079276 | 0.80 | CYP19A1 (0.49) | CYP17A1CYP19A1CYP11B1CYP11B2POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109982999-A | The imidazolyl methyl-derivatives that new 5- replaces | 拜耳作物科学股份公司 | 2019-07-05 | — | — | CN | disclosed |
| EP-0049913-A2 | New ethenylimidazole derivatives, processes for their preparation and pharmaceutical compositions containing them; intermediates, useful in their preparation and a process for the preparation thereof | GIST-BROCADES N.V. (NL) | 1982-04-21 | — | — | EP | disclosed |