Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 4/20 | 0.38 |
| ▸ | TLR1 | Q15399 | 4/20 | 0.38 |
| ▸ | SMYD2 | Q9NRG4 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30411002 | 1.00 | TLR2 (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30410385 | 1.00 | TLR2 (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30411340 | 1.00 | TLR2 (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30410806 | 0.93 | TLR2 (0.36) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30411735 | 0.89 | SMYD2 (0.34) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30411596 | 0.86 | HPSE (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30315977 | 0.86 | HPSE (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30411177 | 0.86 | HPSE (0.38) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30411080 | 0.84 | SMYD2 (0.35) | TLR2TLR1SMYD2CYP3A4HTT | |
| SCHEMBL30315994 | 0.84 | SMYD2 (0.35) | TLR2TLR1SMYD2CYP3A4HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4143189-A1 | MACROCYCLIC INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2023-03-08 | — | — | EP | disclosed |