Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 8/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3873020 | 0.76 | CYP19A1 (0.59) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL3873316 | 0.74 | CNR1 (0.49) | CYP19A1CYP11B1KEAP1CNR1CNR2 | |
| SCHEMBL8884360 | 0.74 | CYP19A1 (0.60) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL9026711 | 0.73 | CYP19A1 (0.58) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL3873345 | 0.73 | CYP19A1 (0.59) | CYP19A1CYP11B1KEAP1SLC6A4SLC9A1 | |
| Bromide SCHEMBL8884686 | 0.72 | CYP19A1 (0.57) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL2351866 | 0.70 | CYP19A1 (0.38) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL8714052 | 0.70 | CYP19A1 (0.55) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| SCHEMBL14476937 | 0.70 | KEAP1 (0.53) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E | |
| Hydrochloric Acid SCHEMBL8710447 | 0.69 | CYP19A1 (0.54) | CYP19A1CYP11B1KEAP1SLC6A4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0490816-A2 | Fluoro-compounds | CIBA-GEIGY AG (CH) | 1992-06-17 | — | — | EP | disclosed |