Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESRRG | P62508 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 2/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ESRRB | O95718 | 1/20 | 0.37 |
| ▸ | ME2 | P23368 | 3/20 | 0.37 |
| ▸ | ME1 | P48163 | 3/20 | 0.37 |
| ▸ | ME3 | Q16798 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14764930 | 0.84 | KDM4E (0.45) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL14764819 | 0.83 | DRD2 (0.51) | MAPTGAALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL30602861 | 0.78 | MAPT (0.50) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL30593301 | 0.75 | KDM4E (0.43) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL24452939 | 0.72 | MAPT (0.67) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL7041242 | 0.71 | MAPT (0.68) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL14764534 | 0.70 | DRD2 (0.53) | MAPTGAALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL7334978 | 0.68 | CHKA (0.61) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL526167 | 0.66 | ALDH1A1 (0.63) | KDM4EMAPTGAALMNAALDH1A1 | |
| SCHEMBL10498349 | 0.66 | MAPT (0.62) | KDM4EMAPTGAALMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013036866-A1 | ITRACONAZOLE ANALOGS AND USE THEREOF | THE JOHNS HOPKINS UNIVERSITY (US) | 2013-03-14 | — | — | WO | disclosed |