Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.37 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.37 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL4129 | 0.84 | TSHR (0.47) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL29404220 | 0.84 | TSHR (0.47) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL28117905 | 0.82 | TSHR (0.45) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| Benzene SCHEMBL28042388 | 0.82 | LMNA (0.45) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL16104430 | 0.76 | ENPP2 (0.45) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL31125058 | 0.75 | ENPP2 (0.39) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL24092888 | 0.72 | ALDH1A1 (0.45) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL12270850 | 0.72 | TSHR (0.45) | TSHRALDH1A1ENPP2ORAI1ORAI2 | |
| 1,2-Dichlorobenzene SCHEMBL28043924 | 0.72 | TSHR (0.71) | TSHRLMNAALDH1A1ENPP2ORAI1 | |
| SCHEMBL20085369 | 0.72 | PCSK9 (0.41) | TSHRLMNAALDH1A1ENPP2LIPG |
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-2008063300-A2 | BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE | INFINITY PHARMACEUTICALS, INC. (US) | 2008-05-29 | — | — | WO | disclosed |