Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28674606 | 0.81 | FFAR1 (0.41) | TP53KMT2AMEN1MAPK1RAB9A | |
| SCHEMBL29003619 | 0.72 | LMNA (0.45) | KMT2AMEN1RAB9ANPC1MAPT | |
| SCHEMBL10469 | 0.71 | ALDH1A1 (0.41) | TP53KMT2AMEN1MAPK1MAPT | |
| SCHEMBL11160723 | 0.70 | HSD17B10 (0.39) | TP53KMT2AMAPK1HPGDMAPT | |
| SCHEMBL5458885 | 0.69 | TP53 (0.67) | TP53KMT2AMEN1MAPK1RAB9A | |
| Hydrochloric Acid SCHEMBL5252881 | 0.68 | TP53 (0.65) | TP53KMT2AMEN1MAPK1RAB9A | |
| SCHEMBL9397806 | 0.66 | TP53 (0.47) | TP53KMT2AMEN1MAPK1HPGD | |
| SCHEMBL28605338 | 0.65 | TP53 (0.56) | TP53KMT2AMEN1MAPK1RAB9A | |
| SCHEMBL11211977 | 0.65 | ALDH1A1 (0.45) | TP53KMT2AMEN1RAB9AHPGD | |
| Butyric Acid SCHEMBL27839710 | 0.65 | TP53 (0.55) | TP53KMT2AMEN1MAPK1RAB9A |
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-113861086-B | Synthesis method of sulfur-containing gamma, gamma-diarylamine butyrylamide compound | 温州大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-113861086-A | Synthesis method of sulfur-containing gamma, gamma-diarylamine butyrylamide compound | 温州大学 | 2021-12-31 | — | — | CN | disclosed |