Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.69 |
| ▸ | RAB9A | P51151 | 8/20 | 0.69 |
| ▸ | MEN1 | O00255 | 7/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.69 |
| ▸ | MAPT | P10636 | 2/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.69 |
| ▸ | THRB | P10828 | 1/20 | 0.69 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.69 |
| ▸ | STAT3 | P40763 | 9/20 | 0.67 |
| ▸ | PKM | P14618 | 5/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | MLNR | O43193 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12974237 | 0.89 | NPC1 (0.69) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL8463100 | 0.86 | MEN1 (0.65) | NPC1RAB9AMEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL28423065 | 0.82 | NPC1 (0.74) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL29057183 | 0.82 | STAT3 (0.68) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL29057090 | 0.82 | STAT3 (0.68) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL12974212 | 0.82 | NPC1 (0.78) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL11149506 | 0.82 | KMT2A (1.00) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL29908278 | 0.82 | NPC1 (0.78) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL29056955 | 0.81 | STAT3 (0.61) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL10253103 | 0.81 | NPC1 (0.76) | NPC1RAB9AMEN1KMT2AMAPT |
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-109503510-B | Antibacterial thiazole compound for preventing caries and preparation method thereof | 山东大学 | 2020-07-03 | — | — | CN | claimed |
| CN-109503510-B | Antibacterial thiazole compound for preventing caries and preparation method thereof | 山东大学 | 2020-07-03 | — | — | CN | disclosed |