Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.32 |
| ▸ | CCKAR | P32238 | 1/20 | 0.31 |
| ▸ | CCKBR | P32239 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.31 |
| ▸ | REN | P00797 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.30 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.30 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
| ▸ | CTSL | P07711 | 2/20 | 0.30 |
| ▸ | CTSB | P07858 | 2/20 | 0.30 |
| ▸ | CD47 | Q08722 | 1/20 | 0.30 |
| ▸ | TLR2 | O60603 | 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 | |
|---|---|---|---|---|
| SCHEMBL27041547 | 1.00 | PTPN1 (0.32) | PTPN1SCN9ACCKARCCKBROPRD1 | |
| SCHEMBL30759426 | 0.94 | SCN9A (0.34) | SCN9ACCKARCCKBROPRD1MDM2 | |
| SCHEMBL30759444 | 0.89 | MDM2 (0.38) | SCN9AMDM2RENALDH1A1HPGD | |
| SCHEMBL27041499 | 0.89 | MDM2 (0.38) | SCN9AMDM2RENALDH1A1HPGD | |
| SCHEMBL27041496 | 0.89 | MDM2 (0.38) | SCN9AMDM2RENALDH1A1HPGD | |
| SCHEMBL27041528 | 0.86 | MMP12 (0.34) | RENALDH1A1HPGDDUSP3PTPN5 | |
| SCHEMBL27041505 | 0.86 | MMP12 (0.34) | RENALDH1A1HPGDDUSP3PTPN5 | |
| SCHEMBL27041529 | 0.86 | PTPN1 (0.40) | PTPN1MDM2CTSLCTSBTLR2 | |
| SCHEMBL27041503 | 0.86 | PTPN1 (0.40) | PTPN1MDM2CTSLCTSBTLR2 | |
| SCHEMBL30759380 | 0.85 | SCN9A (0.39) | PTPN1SCN9ACCKARCCKBROPRD1 |
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-2024020159-A1 | MACROCYCLIC PEPTIDES TARGETING KRAS | MERCK SHARP & DOHME LLC (US) | 2024-01-25 | — | — | WO | disclosed |