Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | SCD | O00767 | 1/20 | 0.47 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.47 |
| ▸ | VEGFA | P15692 | 1/20 | 0.45 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2862442 | 0.84 | ALDH1A1 (0.60) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL8210703 | 0.80 | KMT2A (0.55) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL5569584 | 0.78 | GPR119 (0.58) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL11932534 | 0.77 | FAAH (0.57) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL6182303 | 0.77 | ALDH1A1 (0.63) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL892981 | 0.77 | ALDH1A1 (0.54) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL29132192 | 0.77 | FNTA (0.52) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL23529286 | 0.76 | OPRD1 (0.50) | TP53MAPTTHRBALDH1A1VEGFA | |
| SCHEMBL28105762 | 0.76 | VEGFA (0.60) | TP53MAPTTHRBLMNAALDH1A1 | |
| SCHEMBL2363123 | 0.76 | VEGFA (0.56) | TP53MAPTTHRBALDH1A1POLB |
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 |