Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CASR | P41180 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | OGG1 | O15527 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4905651 | 0.82 | KMT2A (0.53) | KMT2ATSHRMAPK1CYP3A4TDP1 | |
| SCHEMBL4905689 | 0.79 | KMT2A (0.53) | KMT2ACASRTSHRMAPK1CYP19A1 | |
| SCHEMBL4909063 | 0.77 | KMT2A (0.54) | KMT2AMAPK1CYP19A1LMNANPC1 | |
| SCHEMBL8415398 | 0.76 | KMT2A (0.56) | KMT2ATSHRMAPK1LMNAHSD17B10 | |
| SCHEMBL4907911 | 0.75 | KMT2A (0.48) | KMT2ACASRTSHRMAPK1TP53 | |
| SCHEMBL11534295 | 0.71 | KMT2A (0.66) | KMT2ATSHRCYP19A1SMN1; SMN2NPC1 | |
| SCHEMBL7914818 | 0.70 | CYP19A1 (0.51) | KMT2ACASRTSHRMAPK1CYP3A4 | |
| SCHEMBL697512 | 0.70 | CYP19A1 (0.51) | KMT2ACASRTSHRMAPK1CYP3A4 | |
| SCHEMBL5924563 | 0.70 | KMT2A (0.41) | KMT2ATSHRMAPK1CYP3A4TP53 | |
| SCHEMBL11532281 | 0.69 | CYP19A1 (0.36) | KMT2ACASRTSHRMAPK1CYP3A4 |
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-1695704-A1 | Derivatives of aryl (or heteroaryl) azolylcarbinols for the treatment of fibromyalgia | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2006-08-30 | — | — | EP | disclosed |