Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | F2R | P25116 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28277840 | 0.90 | KAT6A (0.40) | CD38SMN1; SMN2HTTKAT6ACTSS | |
| SCHEMBL17625005 | 0.80 | CTSS (0.36) | CD38HCRTR1HCRTR2SMN1; SMN2HTT | |
| SCHEMBL8174016 | 0.79 | NPC1 (0.46) | CD38SMN1; SMN2HTTCYP1A2CYP3A4 | |
| SCHEMBL28642784 | 0.76 | GABRA1 (0.39) | HCRTR1HCRTR2HTTCYP1A2CYP3A4 | |
| SCHEMBL7045375 | 0.76 | EZH2 (0.49) | HCRTR1ALDH1A1 | |
| SCHEMBL2362450 | 0.75 | MRGPRX4 (0.47) | HTTHPGDCA9HSD17B10KDM4E | |
| SCHEMBL22620361 | 0.75 | PRKCI (0.42) | HCRTR1HCRTR2HTTCYP1A2CYP3A4 | |
| SCHEMBL8174111 | 0.74 | HPGD (0.53) | SMN1; SMN2HTTKAT6AHPGDNPC1 | |
| SCHEMBL29778078 | 0.74 | ABCB1 (0.52) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL28276332 | 0.74 | KCNK3 (0.40) | SMN1; SMN2HTTCYP1A2CYP3A4HPGD |
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-2016044390-A1 | BORON-CONTAINING DIACYLHYDRAZINE COMPOUNDS | INTREXON CORPORATION (US) | 2016-03-24 | — | — | WO | disclosed |