Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.36 |
| ▸ | USP7 | Q93009 | 1/20 | 0.36 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.35 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL3773661 | 0.82 | AGTR2 (0.50) | AGTR2KDM4EACHE | |
| SCHEMBL23529287 | 0.77 | PTGS1 (0.41) | AGTR2CHRM4 | |
| SCHEMBL23529286 | 0.76 | OPRD1 (0.50) | BRD4CHRM4KDM4EACHE | |
| SCHEMBL21996912 | 0.73 | S1PR5 (0.40) | PTGDR2AGTR2HRH3MGLL | |
| SCHEMBL23922806 | 0.73 | SMN1; SMN2 (0.48) | PKMKDM4E | |
| SCHEMBL5386962 | 0.73 | DRD2 (0.41) | AGTR2CYP2D6KDM4E | |
| SCHEMBL23535924 | 0.72 | CYP11B2 (0.38) | CYP11B2HRH3KDM4E | |
| SCHEMBL211059 | 0.72 | DRD2 (0.43) | PTGDR2AGTR2GAAHRH3KDM4E | |
| SCHEMBL21997577 | 0.72 | CA2 (0.42) | PTGDR2AGTR2GAAHRH3KDM4E | |
| SCHEMBL25317215 | 0.72 | LMNA (0.46) | PTGDR2AGTR2GAAMGLL |
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-2021127273-A1 | 1 -((6-OXO-1,6-DIHYDROPYRIDAZIN-4-YL)METHYL)PIPERAZINE AND 1 -((6-OXO-1,6-DIHYDROPYRIMIDIN-4-YL)METHYL)PIPERAZINE DERIVATIVES AS PROLYL HYDROXYLASE, HIF-1 ALPHA AND PGK MODULATORS FOR USE IN TREATING INFLAMMATORY DISEASES, CANCER OR INFECTIONS | GB004, INC. (US) | 2021-06-24 | — | — | WO | disclosed |