Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28380943 | 1.00 | SLC9A1 (0.48) | SLC9A1LMNATP53MAPTALDH1A1 | |
| SCHEMBL28381110 | 0.83 | NPC1 (0.42) | MAPTALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL28377286 | 0.83 | NPC1 (0.42) | MAPTALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL25346259 | 0.80 | ALDH1A1 (0.46) | SLC9A1LMNATP53MAPTALDH1A1 | |
| SCHEMBL28376946 | 0.78 | AKR1C3 (0.41) | SLC9A1MAPTALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL31703382 | 0.78 | AKR1C3 (0.41) | SLC9A1MAPTALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL31406306 | 0.78 | SLC9A1 (0.59) | SLC9A1LMNATP53MAPTALDH1A1 | |
| SCHEMBL10843264 | 0.77 | TP53 (0.50) | SLC9A1LMNATP53MAPTALDH1A1 | |
| SCHEMBL5775091 | 0.76 | SLC9A1 (0.67) | SLC9A1LMNATP53MAPTALDH1A1 | |
| SCHEMBL7002979 | 0.76 | SLC9A1 (0.67) | SLC9A1LMNATP53MAPTALDH1A1 |
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-111004225-A | Novel piperazine compound and preparation method and application thereof | 兰州大学 | 2020-04-14 | — | — | CN | disclosed |