Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.35 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16695240 | 0.75 | NOTUM (0.62) | NOTUM | |
| SCHEMBL16695146 | 0.74 | NOTUM (0.47) | HTR6KDM2BNOTUMSMN1; SMN2 | |
| SCHEMBL16684690 | 0.74 | NOTUM (0.47) | HTR6KDM2BNOTUMSMN1; SMN2 | |
| SCHEMBL16695100 | 0.74 | NOTUM (0.47) | HTR6KDM2BNOTUMSMN1; SMN2 | |
| SCHEMBL21704260 | 0.73 | HRH4 (0.53) | — | |
| Hydrochloric Acid SCHEMBL17913779 | 0.73 | ESR1 (0.48) | KDM2BTMEM97SIGMAR1 | |
| SCHEMBL26099884 | 0.73 | TRIM24 (0.38) | NOTUMTRIM24TRIM33ALDH1A1KDM4E | |
| SCHEMBL26099880 | 0.73 | TRIM24 (0.38) | NOTUMTRIM24TRIM33ALDH1A1KDM4E | |
| SCHEMBL19904404 | 0.73 | GHSR (0.42) | TRIM24MAOB | |
| SCHEMBL5691206 | 0.73 | IP6K1 (0.48) | HTR6TSHRHCAR1CYP17A1ALDH1A1 |
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 |