Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.30 |
| ▸ | LDHB | P07195 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21340222 | 0.76 | LMNA (0.35) | TAS1R3TAS1R1TAS1R2LDHALDHB | |
| SCHEMBL23732134 | 0.76 | LMNA (0.35) | TAS1R3TAS1R1TAS1R2LDHALDHB | |
| SCHEMBL944378 | 0.72 | CYP2A6 (0.38) | MAPTMEN1ALDH1A1KMT2A | |
| SCHEMBL29120579 | 0.72 | AR (0.41) | ALDH1A1LDHALDHB | |
| SCHEMBL12093642 | 0.70 | MAPT (0.40) | MAPTMEN1ALDH1A1KMT2A | |
| SCHEMBL144551 | 0.66 | — | — | |
| SCHEMBL24181750 | 0.66 | CA1 (0.36) | ALDH1A1 | |
| SCHEMBL19904654 | 0.64 | CA1 (0.34) | MAPTMEN1ALDH1A1KMT2A | |
| SCHEMBL15271945 | 0.64 | TAS1R3 (0.34) | TAS1R3TAS1R1TAS1R2GAAHTR2C | |
| SCHEMBL4755295 | 0.63 | CYP2A6 (0.47) | HTR2BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3063141-B1 | N-(1-HYDROXY-3-(PYRROLIDINYL)PROPAN-2-YL)PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | BIOMARIN PHARM INC (US) | 2018-02-28 | — | — | EP | disclosed |