Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28095284 | 0.83 | SLC6A3 (0.46) | KMT2ARAB9ALMNASMN1; SMN2CNR1 | |
| SCHEMBL27871833 | 0.83 | ADRB2 (0.44) | CNR1PPARA | |
| SCHEMBL16664416 | 0.81 | MEN1 (0.46) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL28095286 | 0.75 | CYP1A2 (0.43) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL28044003 | 0.71 | ALDH1A1 (0.45) | MEN1KMT2ALMNAMAPTCYP1A2 | |
| SCHEMBL13282525 | 0.70 | CNR2 (0.48) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL1432517 | 0.70 | MEN1 (0.47) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL12218440 | 0.69 | RAB9A (0.79) | MEN1KMT2ARAB9ANPC1LMNA | |
| SCHEMBL28095287 | 0.68 | CNR1 (0.49) | MEN1KMT2AMAPTSMN1; SMN2CNR1 | |
| Bicarbonate SCHEMBL1432516 | 0.67 | MEN1 (0.54) | MEN1KMT2ARAB9ANPC1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-106243053-A | A kind of triazolylamide ketone antibacterial, synthetic method and application thereof | 三峡大学 | 2016-12-21 | — | — | CN | disclosed |