Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 3/20 | 0.49 |
| ▸ | MMP13 | P45452 | 3/20 | 0.49 |
| ▸ | MMP9 | P14780 | 2/20 | 0.49 |
| ▸ | MMP14 | P50281 | 2/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11807856 | 0.87 | ALDH1A1 (0.57) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL3970619 | 0.86 | ALDH1A1 (0.72) | TSHRALDH1A1CYP3A4ADORA3LMNA | |
| SCHEMBL17481681 | 0.84 | TSHR (0.61) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL16057394 | 0.84 | TSHR (0.61) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL16057389 | 0.84 | TSHR (0.61) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL16057391 | 0.84 | TSHR (0.61) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL4401404 | 0.83 | TSHR (0.48) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL21751532 | 0.82 | MMP2 (0.64) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL8068632 | 0.82 | MMP2 (0.64) | TSHRALDH1A1CYP3A4ADORA3POLB | |
| SCHEMBL21751533 | 0.82 | MMP2 (0.64) | TSHRALDH1A1CYP3A4ADORA3POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008039367-A1 | SYNTHESIS OF TRANS-TERT-BUTYL-2-AMINOCYCLOPENTYLCARBAMATE | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2008-04-03 | — | — | WO | disclosed |