Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | MME | P08473 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2381114 | 0.81 | PTGS1 (0.42) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL12246290 | 0.81 | PTGS1 (0.42) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL828657 | 0.81 | TSHR (0.61) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL9829311 | 0.79 | HCAR2 (0.50) | TSHRHTTLMNASMN1; SMN2MME | |
| SCHEMBL4167697 | 0.79 | TSHR (0.50) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL4170748 | 0.79 | TSHR (0.50) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL9829305 | 0.79 | HCAR2 (0.50) | TSHRHTTLMNASMN1; SMN2MME | |
| SCHEMBL4168413 | 0.79 | TSHR (0.50) | TSHRTP53HTTALDH1A1NPC1 | |
| SCHEMBL12246287 | 0.76 | ALDH1A1 (0.54) | TSHRALDH1A1RAB9ALMNACYP3A4 | |
| SCHEMBL2381196 | 0.76 | ALDH1A1 (0.54) | TSHRALDH1A1RAB9ALMNACYP3A4 |
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-2008013860-A2 | ACYLOXYALKYL CARBAMATE PRODRUGS OF ALPHA-AMINO ACIDS, METHODS OF SYNTHESIS AND USE | XENOPORT, INC. (US) | 2008-01-31 | — | — | WO | disclosed |