Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MPO | P05164 | 2/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL14116547 | 0.88 | MPO (0.56) | NPSR1PTGS1PTGS2NPC1RAB9A | |
| SCHEMBL29100458 | 0.84 | PTGS1 (0.57) | NPSR1PTGS1PTGS2MEN1KMT2A | |
| SCHEMBL31268550 | 0.84 | LMNA (0.46) | GAANPSR1MEN1KMT2ANPC1 | |
| SCHEMBL29100454 | 0.83 | MPO (0.53) | GAAPTGS1PTGS2MEN1KMT2A | |
| SCHEMBL31268509 | 0.81 | PTGS1 (0.48) | GAANPSR1PTGS1PTGS2NPC1 | |
| SCHEMBL29100460 | 0.80 | PTGS1 (0.50) | GAANPSR1PTGS1PTGS2MEN1 | |
| SCHEMBL31268511 | 0.78 | MPO (0.46) | GAAPTGS1PTGS2NPC1RAB9A | |
| SCHEMBL29042743 | 0.78 | MPO (0.46) | GAAPTGS1PTGS2NPC1RAB9A | |
| SCHEMBL1094058 | 0.77 | ESR2 (0.75) | GAANPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28792817 | 0.77 | ESR2 (0.74) | GAANPSR1NPC1RAB9ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113121318-B | Biheteroaromatic hydrocarbon compound and preparation method thereof | 浙江工业大学 | 2022-04-26 | — | — | CN | disclosed |
| CN-113121318-A | Biheteroaromatic hydrocarbon compound and preparation method thereof | 浙江工业大学 | 2021-07-16 | — | — | CN | disclosed |