Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 3/20 | 0.67 |
| ▸ | THRB | P10828 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | DHFR | P00374 | 1/20 | 0.52 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.52 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9364448 | 0.89 | THRA (0.58) | THRATHRBESR1DHFRPLA2G4B | |
| SCHEMBL9360115 | 0.87 | EGFR (0.63) | THRATHRBKDM4ESMN1; SMN2ABCB1 | |
| SCHEMBL9360111 | 0.87 | THRA (0.60) | THRATHRBKDM4ESMN1; SMN2 | |
| SCHEMBL9824528 | 0.83 | ALDH1A1 (0.57) | THRATHRBALDH1A1MAPTKMT2A | |
| SCHEMBL9365125 | 0.83 | ALDH1A1 (0.62) | THRATHRBALDH1A1MAPTKMT2A | |
| SCHEMBL11258532 | 0.80 | ALDH1A1 (0.57) | ALDH1A1MAPTKMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL11730534 | 0.79 | THRA (0.60) | THRATHRBALDH1A1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL8705220 | 0.79 | ESR1 (0.66) | THRATHRBALDH1A1MAPTKMT2A | |
| SCHEMBL7166019 | 0.78 | RAB9A (0.69) | ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL9151866 | 0.77 | THRA (0.66) | THRATHRB |
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-0410359-B1 | Substituted aminoalkoxy-benzene-derivatives | HOFFMANN LA ROCHE (CH) | 1994-01-26 | — | — | EP | disclosed |
| US-5214046-A | Synergistic mixtures, inhibitors of sterol biosynthesis | HOFFMANN-LA ROCHE INC. (US) | 1993-05-25 | — | — | US | disclosed |