Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 2/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | CCR8 | P51685 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | ATP4A | P20648 | 1/20 | 0.34 |
| ▸ | ATP4B | P51164 | 1/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24009148 | 0.87 | HPGDS (0.55) | SLC6A3HPGDSSRCEGFRERBB2 | |
| SCHEMBL16132482 | 0.73 | CCR1 (0.55) | CCR1CCR5CCR8LRRK2TSHR | |
| SCHEMBL6381401 | 0.71 | HPGDS (0.54) | SLC6A3HPGDSSRCEGFRERBB2 | |
| SCHEMBL3151307 | 0.69 | LRRK2 (0.58) | SRCEGFRERBB2IMPDH2IMPDH1 | |
| SCHEMBL24392645 | 0.69 | HPGDS (0.51) | SLC6A3HPGDSSRCIMPDH2IMPDH1 | |
| SCHEMBL24391743 | 0.69 | HPGDS (0.51) | SLC6A3HPGDSSRCEGFRERBB2 | |
| SCHEMBL24009068 | 0.69 | EGFR (0.41) | SLC6A3HPGDSEGFRERBB2 | |
| SCHEMBL24009065 | 0.69 | ALDH1A1 (0.43) | SLC6A3HPGDSSRCEGFRERBB2 | |
| SCHEMBL16132474 | 0.68 | CCR1 (0.57) | HPGDSCCR1CCR5CCR8ATP4A | |
| SCHEMBL4376539 | 0.66 | KDM4E (0.50) | SLC6A3HPGDSSRCEGFRERBB2 |
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-2022091048-A1 | ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF | INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) | 2022-05-05 | — | — | WO | disclosed |