Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 5/20 | 0.34 |
| ▸ | CASP6 | P55212 | 2/20 | 0.34 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSV | O60911 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSH | P09668 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | CTSF | Q9UBX1 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8063168 | 0.88 | MAPT (0.48) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL12636212 | 0.76 | TSHR (0.47) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL12342059 | 0.73 | KDM4E (0.42) | KDM4EMAPTALDH1A1HTTCASP7 | |
| SCHEMBL3216951 | 0.72 | MAPT (0.50) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL13382341 | 0.71 | TSHR (0.56) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL22308325 | 0.70 | MAPT (0.49) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL4737840 | 0.70 | ALDH1A1 (0.39) | KDM4EMAPTALDH1A1HTTTSHR | |
| SCHEMBL26623341 | 0.69 | MAPT (0.48) | KDM4EMAPTALDH1A1HTTMAPK1 | |
| SCHEMBL19360006 | 0.69 | KMT2A (0.36) | MAPTHTTMAPK1TSHR | |
| SCHEMBL22307837 | 0.69 | KDM4E (0.55) | KDM4EMAPTALDH1A1HTTMAPK1 |
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-2009075778-A2 | NONPEPTIDIC INHIBITORS OF CRUZAIN | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-06-18 | — | — | WO | disclosed |