Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GCGR | P47871 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL7875042 | 0.81 | MAPT (0.43) | NOTUMKDM4EPKMALDH1A1SMN1; SMN2 | |
| SCHEMBL363148 | 0.80 | GAA (0.41) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL27928339 | 0.80 | PRKCZ (0.42) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL28642520 | 0.80 | ALDH1A1 (0.38) | NPC1RAB9APKMALDH1A1SMN1; SMN2 | |
| SCHEMBL386070 | 0.79 | CYP2A6 (0.41) | NOTUMNPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6651524 | 0.77 | KDM4E (0.60) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10965014 | 0.73 | CYP2A6 (0.56) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL27968877 | 0.73 | LTA4H (0.45) | NPC1RAB9ACYP19A1LTA4H | |
| SCHEMBL4600920 | 0.69 | GCGR (0.42) | NOTUMNPC1RAB9AKDM4EPKM | |
| SCHEMBL436851 | 0.68 | AHR (0.38) | NOTUMNPC1RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108026050-B | Novel compounds as ROR gamma modulators | 格兰马克药品股份有限公司 | 2021-04-30 | — | — | CN | disclosed |