Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 7/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CCNC | P24863 | 1/20 | 0.30 |
| ▸ | CDK8 | P49336 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21222647 | 0.93 | SCN9A (0.37) | MALT1GPBAR1ACKR3SCN9AHCRTR1 | |
| SCHEMBL21222650 | 0.93 | SCN9A (0.37) | MALT1GPBAR1ACKR3SCN9AHCRTR1 | |
| SCHEMBL21222010 | 0.90 | SCN9A (0.36) | MALT1GPBAR1ACKR3SCN9AHCRTR1 | |
| SCHEMBL21222012 | 0.90 | SCN9A (0.36) | MALT1GPBAR1ACKR3SCN9AHCRTR1 | |
| SCHEMBL20064413 | 0.88 | GPBAR1 (0.34) | MALT1GPBAR1ACKR3SCN9A | |
| SCHEMBL20064528 | 0.80 | SCN9A (0.37) | MALT1SCN9A | |
| SCHEMBL21222312 | 0.80 | ACKR3 (0.38) | MALT1ACKR3SCN9ACCNCCDK8 | |
| SCHEMBL21221932 | 0.80 | SCN9A (0.39) | MALT1ACKR3SCN9AHCRTR1HCRTR2 | |
| SCHEMBL21222321 | 0.80 | SLC6A9 (0.33) | MALT1ACKR3 | |
| SCHEMBL21222322 | 0.80 | SLC6A9 (0.33) | MALT1ACKR3 |
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-2018069863-A1 | 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-04-19 | — | — | WO | disclosed |