Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MPO | P05164 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.54 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.54 |
| ▸ | ECE1 | P42892 | 10/20 | 0.54 |
| ▸ | GHSR | Q92847 | 1/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30169836 | 0.95 | ERAP2 (0.63) | ACEERAP2ECE1 | |
| SCHEMBL21641798 | 0.94 | KDM4E (0.62) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL5970454 | 0.94 | KDM4E (0.62) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL30563239 | 0.91 | OPRD1 (0.67) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL29376316 | 0.91 | ERAP2 (0.67) | ACEERAP2ECE1 | |
| SCHEMBL10753134 | 0.90 | ACE (0.71) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL10753140 | 0.90 | ACE (0.71) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL31259939 | 0.90 | ACE (0.71) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL29448058 | 0.90 | ACE (0.71) | ACEKDM4EMEN1LMNAMPO | |
| SCHEMBL5271276 | 0.89 | GHSR (0.55) | GHSR |
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-4076493-A1 | MACROCYCLIC PEPTIDES AS POTENT INHIBITORS OF K-RAS G12D MUTANT | Merck Sharp & Dohme LLC (US) | 2022-10-26 | — | — | EP | disclosed |