Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28662847 | 0.79 | ALDH1A1 (0.46) | NPC1RAB9ACYP3A4LMNAMAPT | |
| SCHEMBL11687089 | 0.79 | ALDH1A1 (0.42) | CYP3A4LMNAMAPTALDH1A1TP53 | |
| SCHEMBL11733174 | 0.79 | RAB9A (0.46) | NPC1RAB9ACYP3A4ADRA2AMAPT | |
| SCHEMBL11581911 | 0.79 | RAB9A (0.33) | NPC1RAB9ACYP3A4ADRA2ALMNA | |
| SCHEMBL28108539 | 0.79 | MAPT (0.36) | NPC1RAB9ACYP3A4ADRA2ALMNA | |
| Hydrochloric Acid SCHEMBL27509106 | 0.78 | RAB9A (0.33) | NPC1RAB9ACYP3A4ADRA2ALMNA | |
| SCHEMBL11317412 | 0.76 | ACHE (0.50) | RAB9ACYP3A4MAPTALDH1A1TDP1 | |
| SCHEMBL28145329 | 0.75 | NPC1 (0.52) | NPC1RAB9ACYP3A4MAPTALDH1A1 | |
| SCHEMBL11726779 | 0.75 | SMN1; SMN2 (0.35) | NPC1RAB9AMAPTALDH1A1TP53 | |
| SCHEMBL12589735 | 0.75 | RAB9A (0.50) | NPC1RAB9ACYP3A4ADRA2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-116217452-A | 4-pentenimidosulfonyl amidine series compound, preparation method and application thereof | 浙大城市学院 | 2023-06-06 | — | — | CN | disclosed |
| CN-110015971-A | One kind preparing α, α-diamides base alkane derivative method with N, N '-dialkyl amide | 温州大学 | 2019-07-16 | — | — | CN | disclosed |
| US-4424156-A | Halo-substituted amino-and substituted-sulphonamido-containing azo dyestuffs | BAYER AKTIENGESELLSCHAFT (DE) | 1984-01-03 | — | — | US | disclosed |