Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 3/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MLNR | O43193 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3224885 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL723033 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL3642818 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL1317994 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL3227070 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL3231723 | 0.96 | EPHX1 (0.45) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL3233675 | 0.92 | EPHX1 (0.40) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL9815647 | 0.85 | TSHR (0.47) | EPHX1SHBGTP53ALDH1A1HSD17B10 | |
| SCHEMBL6373939 | 0.85 | EPHX1 (0.40) | EPHX1SHBGTP53LMNAKDM4E | |
| SCHEMBL15911102 | 0.84 | EPHX1 (0.33) | EPHX1SHBGTP53 |
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-1599465-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | Bayer CropScience AG (DE) | 2005-11-30 | — | — | EP | disclosed |
| WO-2004074274-A1 | SUBSTITUTED N-ARYL NITROGEN HETEROCYCLES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2004-09-02 | — | — | WO | disclosed |