Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.51 |
| ▸ | GBA1 | P04062 | 6/20 | 0.42 |
| ▸ | UGCG | Q16739 | 4/20 | 0.42 |
| ▸ | GBA2 | Q9HCG7 | 4/20 | 0.42 |
| ▸ | LCT | P09848 | 3/20 | 0.42 |
| ▸ | MGAM | O43451 | 2/20 | 0.42 |
| ▸ | SI | P14410 | 2/20 | 0.42 |
| ▸ | MAN1B1 | Q9UKM7 | 7/20 | 0.39 |
| ▸ | MAN2A1 | Q16706 | 6/20 | 0.39 |
| ▸ | GUSB | P08236 | 1/20 | 0.34 |
| ▸ | MAN2B1 | O00754 | 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 | |
|---|---|---|---|---|
| SCHEMBL28443468 | 0.89 | SPHK1 (0.49) | SPHK1GBA1UGCGGBA2LCT | |
| SCHEMBL28442549 | 0.77 | SPHK1 (0.53) | SPHK1GBA1UGCGGBA2LCT | |
| SCHEMBL28431564 | 0.71 | SPHK1 (0.69) | SPHK1GBA1GBA2GUSB | |
| SCHEMBL28449440 | 0.71 | SPHK1 (0.52) | SPHK1MAN1B1MAN2A1 | |
| SCHEMBL28448560 | 0.69 | SPHK1 (1.00) | SPHK1GBA1GBA2GUSB | |
| SCHEMBL28896122 | 0.69 | SPHK1 (1.00) | SPHK1GBA1GBA2GUSB | |
| SCHEMBL10462978 | 0.68 | NPC1 (0.46) | GBA1UGCGGBA2LCTMGAM | |
| SCHEMBL9234762 | 0.68 | UGCG (0.44) | GBA1UGCGGBA2LCTMGAM | |
| SCHEMBL11213967 | 0.68 | NPC1 (0.46) | GBA1UGCGGBA2LCTMGAM | |
| SCHEMBL28452733 | 0.68 | SPHK1 (0.72) | SPHK1GBA1GBA2MGAMSI |
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 |
|---|---|---|---|---|---|---|---|
| CN-111574421-B | 2,3, 4-trisubstituted pyrrolidine compound and preparation method and application thereof | 山东省医学科学院药物研究所（山东省抗衰老研究中心、山东省新技术制药研究所） | 2021-04-16 | — | — | CN | disclosed |
| CN-111574421-A | 2,3, 4-trisubstituted pyrrolidine compound and preparation method and application thereof | 山东省医学科学院药物研究所（山东省抗衰老研究中心、山东省新技术制药研究所） | 2020-08-25 | — | — | CN | disclosed |