Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 10/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19851743 | 0.85 | TLR2 (0.55) | TLR2 | |
| SCHEMBL19411953 | 0.69 | EPHX2 (0.47) | CNR1CNR2SIGMAR1EPHX2MEN1 | |
| Benzene SCHEMBL27952372 | 0.69 | MAOA (0.65) | ALDH1A1HPGDCNR1CNR2KDM4E | |
| Hexadecylamine SCHEMBL29233491 | 0.68 | TLR2 (0.52) | TLR2ALDH1A1TSHRSIGMAR1EPHX2 | |
| Hydrochloric Acid SCHEMBL120260 | 0.68 | EPHX2 (0.46) | CNR1CNR2SIGMAR1EPHX2MEN1 | |
| SCHEMBL19851685 | 0.68 | TLR2 (0.49) | TLR2ALDH1A1HPGDCNR1CNR2 | |
| SCHEMBL9320936 | 0.68 | MAOA (0.62) | ALDH1A1HPGDCNR1CNR2KDM4E | |
| SCHEMBL2368921 | 0.67 | EPHX2 (0.50) | TLR2ALDH1A1HPGDCNR1CNR2 | |
| SCHEMBL9275691 | 0.67 | DNM1 (0.50) | ALDH1A1TSHRMEN1KMT2ALMNA | |
| SCHEMBL21657637 | 0.66 | KDM4E (0.59) | TLR2ALDH1A1HPGDCNR1CNR2 |
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 |