Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337769 | 0.75 | NPC1 (0.42) | NPC1RAB9AHSD17B10MAPK8KCNA5 | |
| SCHEMBL14142510 | 0.74 | EPHX1 (0.47) | ALDH1A1NPC1RAB9AHSD17B10EPHX1 | |
| SCHEMBL28335753 | 0.74 | ALDH1A1 (0.59) | ALDH1A1HTTNPC1RAB9AHSD17B10 | |
| SCHEMBL8701292 | 0.73 | ALDH1A1 (0.43) | ALDH1A1HTTNPC1RAB9AHSD17B10 | |
| SCHEMBL126140 | 0.70 | HSD17B10 (0.54) | ALDH1A1NPC1RAB9AHSD17B10KDM4E | |
| SCHEMBL242843 | 0.69 | HSD17B10 (0.55) | ALDH1A1HTTNPC1RAB9AHSD17B10 | |
| SCHEMBL8122573 | 0.69 | POLB (0.63) | ALDH1A1HTTNPC1RAB9AKDM4E | |
| SCHEMBL22361721 | 0.68 | NPC1 (0.68) | ALDH1A1HTTNPC1RAB9AHSD17B10 | |
| SCHEMBL5108159 | 0.68 | NPC1 (0.69) | ALDH1A1HTTNPC1RAB9AHSD17B10 | |
| SCHEMBL4677107 | 0.68 | MEN1 (0.58) | ALDH1A1HTTNPC1RAB9AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0749425-A1 | NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME | SAMJIN PHARM. CO., LTD. (KR) | 1996-12-27 | — | — | EP | disclosed |
| 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 |