Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 4/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 5/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27159625 | 1.00 | CCR5 (0.49) | CCR5SLC6A4SLC6A2SLC6A3RORC | |
| SCHEMBL29964698 | 0.90 | CCR5 (0.55) | CCR5SLC6A4SLC6A2SLC6A3NPY1R | |
| SCHEMBL30816203 | 0.84 | SLC6A4 (0.45) | CCR5SLC6A4NPY1RXDHHRH3 | |
| SCHEMBL29963922 | 0.81 | NPY1R (0.48) | CCR5SLC6A4SLC6A2SLC6A3NPY1R | |
| SCHEMBL27159666 | 0.77 | RORC (0.35) | RORCXDHDHFRDCPSHRH3 | |
| SCHEMBL22820749 | 0.76 | SLC6A4 (0.39) | CCR5SLC6A4SLC6A2SLC6A3NPY1R | |
| SCHEMBL22262411 | 0.75 | P2RX4 (0.44) | RORC | |
| SCHEMBL29660060 | 0.75 | P2RX4 (0.44) | RORC | |
| SCHEMBL29964495 | 0.75 | PTGDR2 (0.51) | CCR5XDHDHFRDCPS | |
| SCHEMBL27159746 | 0.75 | PTGDR2 (0.51) | CCR5XDHDHFRDCPS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4330246-A1 | HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) | Ontario Institute for Cancer Research (OICR) (CA) | 2024-03-06 | — | — | EP | disclosed |
| CN-117597336-A | Halogen substituted amino aza-heteroaryl compounds as inhibitors of hematopoietic progenitor kinase 1 (HPK 1) | 安大略省癌症研究所(OICR) | 2024-02-23 | — | — | CN | disclosed |
| WO-2022226665-A1 | HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) | ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) | 2022-11-03 | — | — | WO | disclosed |