Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Econazole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 14/20 | 0.95 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.95 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.95 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.95 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.95 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.95 |
| ▸ | LMNA | P02545 | 4/20 | 0.95 |
| ▸ | NR1I2 | O75469 | 4/20 | 0.95 |
| ▸ | PGR | P06401 | 4/20 | 0.95 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.95 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.95 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.95 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.95 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.95 |
| ▸ | MEN1 | O00255 | 3/20 | 0.95 |
| ▸ | TSHR | P16473 | 3/20 | 0.95 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.95 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.95 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.95 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.95 |
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 | |
|---|---|---|---|---|
| Econazole SCHEMBL20482166 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL34499 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL29440264 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL7602990 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL34498 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL7602993 | 0.98 | IDO1 (1.00) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Miconazole SCHEMBL3226260 | 0.92 | IDO1 (0.89) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL8937292 | 0.91 | IDO1 (0.88) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL18614749 | 0.91 | IDO1 (0.88) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 | |
| Econazole SCHEMBL18614748 | 0.91 | IDO1 (0.88) | IDO1CYP2C9CYP3A4CYP1A2CYP2D6 |
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-2363019-A2 | Reverse breeding | Rijk Zwaan Zaadteelt en Zaadhandel B.V. (NL) | 2011-09-07 | — | — | EP | disclosed |