Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10489352 | 0.84 | ALDH1A1 (0.60) | KCNH3ABL1CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL8244931 | 0.81 | KCNH3 (0.57) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL7393433 | 0.79 | KCNH3 (0.60) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL8589161 | 0.79 | EPHX1 (0.60) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL5544302 | 0.78 | ABL1 (0.41) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL27642277 | 0.78 | F2R (0.48) | ABL1CYP1A2ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL11129979 | 0.77 | EPHX1 (0.62) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL11684553 | 0.77 | EPHX1 (0.62) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL11683978 | 0.77 | EPHX1 (0.62) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL11683181 | 0.77 | EPHX1 (0.62) | KCNH3ABL1CYP1A2ALDH1A1CYP3A4 |
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 |