Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.56 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 1/20 | 0.55 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3284280 | 1.00 | SMN1; SMN2 (0.68) | SMN1; SMN2HTTGLAHSD17B10ACHE | |
| SCHEMBL22622323 | 0.92 | GLA (0.70) | SMN1; SMN2HTTGLAHSD17B10PDK2 | |
| SCHEMBL4724682 | 0.91 | SMN1; SMN2 (0.66) | SMN1; SMN2HTTGLAHSD17B10ACHE | |
| SCHEMBL3319140 | 0.91 | HSD17B10 (0.74) | SMN1; SMN2HTTGLAHSD17B10HPGD | |
| SCHEMBL3319143 | 0.91 | HSD17B10 (0.74) | SMN1; SMN2HTTGLAHSD17B10HPGD | |
| SCHEMBL9029952 | 0.90 | SMN1; SMN2 (0.82) | SMN1; SMN2HTTACHEMGLLHSD11B1 | |
| SCHEMBL16695294 | 0.87 | ACHE (0.60) | SMN1; SMN2ACHEEPHX2PDK2MGLL | |
| SCHEMBL27812707 | 0.86 | SMN1; SMN2 (0.58) | SMN1; SMN2HTTGLAHSD17B10ACHE | |
| SCHEMBL22622475 | 0.86 | GLA (0.72) | SMN1; SMN2HTTGLAHSD17B10MEN1 | |
| SCHEMBL1719734 | 0.85 | MGLL (0.68) | ACHEEPHX2MGLLHSD11B1MEN1 |
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-2015065937-A1 | N-(1-HYDROXY-3-(PYRROLIDINYL)PROPAN-2-YL)PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | BIOMARIN PHARMACEUTICAL INC. (US) | 2015-05-07 | — | — | WO | disclosed |