Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 9/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL19839637 | 0.74 | TLR2 (0.53) | CASR | |
| SCHEMBL19851537 | 0.74 | HDAC8 (0.53) | BCHEHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL4923929 | 0.72 | HDAC8 (0.66) | HDAC3HDAC1HDAC2HDAC8MEN1 | |
| SCHEMBL7446128 | 0.71 | MEN1 (0.54) | HDAC3HDAC1HDAC2HDAC8MEN1 | |
| SCHEMBL13021557 | 0.71 | MC5R (0.54) | BCHEHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL6889945 | 0.69 | FFAR1 (0.60) | HDAC3HDAC1HDAC2HDAC8MEN1 | |
| SCHEMBL9609729 | 0.69 | MC5R (0.41) | CASRBCHEMEN1KMT2AKDM1A | |
| SCHEMBL1285449 | 0.68 | IDO1 (0.56) | HDAC3HDAC1HDAC2HDAC8MEN1 | |
| SCHEMBL1285849 | 0.68 | MC5R (0.50) | CASRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL1703414 | 0.67 | MC5R (0.49) | CASRBCHEHDAC3HDAC1HDAC2 |
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-2018026866-A1 | LIPID-SUBSTITUTED AMINO 1,2-AND 1,3-DIOL COMPOUNDS AS MODULATORS OF TLR2 DIMERIZATION | NEUROPORE THERAPIES, INC. (US) | 2018-02-08 | — | — | WO | disclosed |