Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 4/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | WDR91 | A4D1P6 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | UGCG | Q16739 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19904651 | 0.89 | CCR1 (0.43) | NOTUMCCR1HTR1AMEN1ALDH1A1 | |
| SCHEMBL19904415 | 0.89 | CCR1 (0.43) | NOTUMCCR1HTR1AMEN1ALDH1A1 | |
| SCHEMBL19904316 | 0.89 | UGCG (0.43) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904428 | 0.89 | UGCG (0.43) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904540 | 0.88 | CCR1 (0.41) | NOTUMCCR1HTR1AFFAR1MEN1 | |
| SCHEMBL19904478 | 0.88 | UGCG (0.43) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904504 | 0.88 | UGCG (0.41) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904697 | 0.88 | UGCG (0.41) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904680 | 0.87 | UGCG (0.42) | NOTUMCCR1HTR1AFFAR1UGCG | |
| SCHEMBL19904655 | 0.86 | UGCG (0.42) | NOTUMCCR1HTR1AFFAR1UGCG |
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 |