Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.42 |
| ▸ | DEGS1 | O15121 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.35 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | LIPE | Q05469 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19904665 | 0.93 | HTR1A (0.41) | GPR119NOTUMCHRM4HTR1A | |
| SCHEMBL19904546 | 0.88 | ACACB (0.43) | DEGS1NOTUMCHRM4ACACBSSTR1 | |
| SCHEMBL19904492 | 0.88 | ACACB (0.43) | DEGS1NOTUMCHRM4ACACBSSTR1 | |
| SCHEMBL16695288 | 0.84 | UGCG (0.44) | GPR119DEGS1NOTUMCHRM4CYP2C9 | |
| SCHEMBL18094837 | 0.84 | UGCG (0.44) | GPR119DEGS1NOTUMCHRM4CYP2C9 | |
| SCHEMBL29605118 | 0.84 | UGCG (0.44) | GPR119DEGS1NOTUMCHRM4CYP2C9 | |
| SCHEMBL29605212 | 0.84 | UGCG (0.44) | GPR119DEGS1NOTUMCHRM4CYP2C9 | |
| SCHEMBL16695348 | 0.84 | UGCG (0.44) | GPR119DEGS1NOTUMCHRM4CYP2C9 | |
| SCHEMBL19904460 | 0.81 | ACACB (0.41) | NOTUMCHRM4HTR1AACACB | |
| SCHEMBL19904658 | 0.81 | ACACB (0.41) | NOTUMCHRM4HTR1AACACB |
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 |