Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 9/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.42 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27742029 | 0.81 | CYP17A1 (0.47) | CYP17A1KDM4ECYP19A1KMT2A | |
| SCHEMBL17598731 | 0.81 | CYP17A1 (0.47) | CYP17A1KDM4ECYP19A1KMT2A | |
| SCHEMBL571582 | 0.81 | CYP17A1 (0.47) | CYP17A1KDM4ECYP19A1KMT2A | |
| Bromide SCHEMBL28046942 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Hydrochloric Acid SCHEMBL10488982 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Hydrochloric Acid SCHEMBL28014025 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Iodide SCHEMBL13518969 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Water SCHEMBL28065165 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Fluoride SCHEMBL28247974 | 0.79 | CYP17A1 (0.46) | CYP17A1KDM4ECYP19A1KMT2A | |
| Mandelic Acid SCHEMBL28030120 | 0.78 | KDM4E (0.54) | CYP17A1KDM4ECYP19A1CYP26A1MAPK1 |
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-104829847-A | Junction-functionalized block copolymers | UNIV CALIFORNIA | 2015-08-12 | — | — | CN | disclosed |