Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.54 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.54 |
| ▸ | PGR | P06401 | 6/20 | 0.54 |
| ▸ | AR | P10275 | 4/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 7/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5034365 | 1.00 | CYP3A4 (0.54) | CYP3A4NR3C1PGRARUSP2 | |
| Formocortal SCHEMBL4354 | 0.92 | HIF1A (0.52) | CYP3A4NR3C1PGRARUSP2 | |
| Formocortal SCHEMBL21234455 | 0.92 | HIF1A (0.52) | CYP3A4NR3C1PGRARUSP2 | |
| Formocortal SCHEMBL4353 | 0.92 | HIF1A (0.52) | CYP3A4NR3C1PGRARUSP2 | |
| Formocortal SCHEMBL5484249 | 0.92 | HIF1A (0.52) | CYP3A4NR3C1PGRARUSP2 | |
| SCHEMBL21234457 | 0.90 | CYP3A4 (0.50) | CYP3A4NR3C1PGRARUSP2 | |
| SCHEMBL3099600 | 0.84 | CYP3A4 (0.46) | CYP3A4NR3C1PGRARUSP2 | |
| SCHEMBL3099607 | 0.84 | CYP3A4 (0.46) | CYP3A4NR3C1PGRARUSP2 | |
| SCHEMBL3099611 | 0.84 | CYP3A4 (0.46) | CYP3A4NR3C1PGRARUSP2 | |
| SCHEMBL25854502 | 0.83 | HIF1A (0.45) | CYP3A4NR3C1PGRARUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6740326-B1 | WATER-FREE TOPICAL APPLICATION COMPOSITION FOR TREATMENT OF NAIL DISEASES AND NAIL CARE CONSISTING OF ANTIMYCOTIC AGENT AND LOWER ALKYL ESTER OF LACTIC ACID, MALIC ACID, TARTARIC ACID OR CITRIC ACID AS PENETRATION PROMOTING CARRIER | BIOEQUAL AG (CH) | 2004-05-25 | — | — | US | disclosed |