Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 15/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 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 | |
|---|---|---|---|---|
| SCHEMBL31751759 | 0.85 | CDC7 (0.41) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL2230256 | 0.81 | NFATC1 (0.46) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL27647386 | 0.74 | RAPGEF4 (0.37) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL23084376 | 0.74 | SLC6A2 (0.50) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL2127959 | 0.73 | SLC22A12 (0.44) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL13892321 | 0.71 | CDK4 (0.45) | — | |
| SCHEMBL18821952 | 0.71 | CYP19A1 (0.40) | CYP19A1MAPTCDC7CDK2SLC22A12 | |
| SCHEMBL1892608 | 0.69 | CYP19A1 (0.49) | CYP19A1MAPTCDC7CDK2 | |
| SCHEMBL18821827 | 0.69 | CYP19A1 (0.49) | CYP19A1MAPTCDC7CDK2 | |
| SCHEMBL255050 | 0.69 | MAPT (0.68) | CYP19A1MAPTCDC7CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112279849-A | N-difluoromethyl azaindole compound and synthesis method thereof | 丽水学院 | 2021-01-29 | — | — | CN | disclosed |