Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9575228 | 0.87 | — | — | |
| SCHEMBL9575635 | 0.82 | TPMT (0.35) | ALDH1A1 | |
| SCHEMBL11312257 | 0.81 | ELANE (0.45) | CYP3A4HPGDCRHBPCRHR2HSD17B10 | |
| SCHEMBL9575524 | 0.81 | HPGD (0.33) | CYP3A4HPGDHSD17B10ALDH1A1 | |
| SCHEMBL9575423 | 0.79 | AKR1B1 (0.38) | CYP3A4HPGDHSD17B10 | |
| SCHEMBL9575641 | 0.79 | MAPT (0.42) | HSD17B10 | |
| SCHEMBL9575199 | 0.78 | MEN1 (0.41) | CYP3A4HPGDHSD17B10ALDH1A1 | |
| SCHEMBL9575148 | 0.76 | CYP4F2 (0.41) | — | |
| SCHEMBL16641111 | 0.74 | — | — | |
| SCHEMBL9575359 | 0.74 | ELANE (0.42) | CYP3A4HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0249867-B1 | SUBSTITUTED PHENYL ESTERS OF ALPHA-FLUOROACRYLIC ACID | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-01-02 | — | — | EP | disclosed |
| EP-0249867-A2 | Substituted phenyl esters of alpha-fluoroacrylic acid | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-12-23 | — | — | EP | disclosed |