Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.48 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | IDH1 | O75874 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4799566 | 0.79 | ALDH1A1 (0.63) | ALDH1A1GPR27MEN1KMT2AMAPT | |
| SCHEMBL19303573 | 0.71 | TSHR (0.53) | ALDH1A1POLBMEN1KMT2AMAPT | |
| SCHEMBL25899790 | 0.70 | GAA (0.42) | ALDH1A1POLBMEN1KMT2AHTT | |
| SCHEMBL7562043 | 0.70 | ALDH1A1 (1.00) | ALDH1A1POLBGPR27MEN1KMT2A | |
| SCHEMBL14818763 | 0.69 | ALDH1A1 (0.69) | ALDH1A1GPR27MEN1KMT2ANPSR1 | |
| SCHEMBL812704 | 0.69 | SLC40A1 (0.60) | ALDH1A1POLBHTTNPSR1TSHR | |
| SCHEMBL14048159 | 0.68 | POLB (0.57) | ALDH1A1POLBMEN1KMT2AHTT | |
| SCHEMBL13128915 | 0.68 | MEN1 (0.57) | ALDH1A1MEN1KMT2AHTTKDM4E | |
| SCHEMBL7588364 | 0.68 | SLC40A1 (0.63) | MEN1KMT2AMAPTLMNATSHR | |
| SCHEMBL8357192 | 0.67 | PKM (0.49) | ALDH1A1POLBMEN1KMT2AHTT |
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-109320441-A | Method for efficiently preparing alkynylamide compound | 江西师范大学 | 2019-02-12 | — | — | CN | disclosed |