Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL9016295 | 0.97 | NPC1 (0.39) | GRM1SMN1; SMN2NPC1JAK2RAB9A | |
| SCHEMBL9016302 | 0.94 | GRM1 (0.38) | GRM1SMN1; SMN2HTTALDH1A1TSHR | |
| SCHEMBL8701288 | 0.87 | ALDH1A1 (0.40) | GRM1SMN1; SMN2NPC1RAB9AHTT | |
| SCHEMBL9058099 | 0.81 | NPC1 (0.36) | GRM1SMN1; SMN2NPC1JAK2RAB9A | |
| SCHEMBL9016285 | 0.77 | NPC1 (0.38) | GRM1SMN1; SMN2NPC1JAK2RAB9A | |
| SCHEMBL7626374 | 0.76 | MEN1 (0.40) | GRM1SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL9058202 | 0.74 | FAAH (0.47) | NPC1RAB9AGAA | |
| SCHEMBL8699837 | 0.73 | TACR3 (0.40) | ALDH1A1MAPT | |
| SCHEMBL9016298 | 0.73 | BRD4 (0.47) | NPC1RAB9AGAA | |
| SCHEMBL9016301 | 0.72 | TAAR1 (0.52) | NPC1RAB9AGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996021648-A1 | NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 1996-07-18 | — | — | WO | disclosed |