Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 11/20 | 0.76 |
| ▸ | CPB1 | P15086 | 1/20 | 0.49 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.48 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.48 |
| ▸ | CHRNG | P07510 | 3/20 | 0.48 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.48 |
| ▸ | CHRND | Q07001 | 3/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL19839565 | 0.99 | TLR2 (0.74) | TLR2CPB1CPB2TSHRSIRT2 | |
| Hydrochloric Acid SCHEMBL19839568 | 0.99 | TLR2 (0.74) | TLR2CPB1CPB2TSHRSIRT2 | |
| SCHEMBL19839899 | 0.91 | TLR2 (0.92) | TLR2SIRT2SIRT1SIRT3CHRNA1 | |
| SCHEMBL19839897 | 0.91 | TLR2 (0.92) | TLR2SIRT2SIRT1SIRT3CHRNA1 | |
| SCHEMBL19839636 | 0.90 | TLR2 (0.63) | TLR2TSHRSIRT2SIRT1 | |
| SCHEMBL19839633 | 0.90 | TLR2 (0.63) | TLR2TSHRSIRT2SIRT1 | |
| Hydrochloric Acid SCHEMBL19839829 | 0.90 | TLR2 (0.90) | TLR2SIRT2SIRT1SIRT3CHRNA1 | |
| Hydrochloric Acid SCHEMBL19839828 | 0.90 | TLR2 (0.90) | TLR2SIRT2SIRT1SIRT3CHRNA1 | |
| SCHEMBL19851736 | 0.86 | TLR2 (1.00) | TLR2SIRT2SIRT1SIRT3CHRNA1 | |
| Hydrochloric Acid SCHEMBL19839583 | 0.85 | TLR2 (0.98) | TLR2SIRT2SIRT1SIRT3 |
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 |