Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | TLR2 | O60603 | 4/20 | 0.33 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7438474 | 0.88 | TLR2 (0.36) | TLR2CTSKKMT2ACASP3 | |
| SCHEMBL4432786 | 0.79 | BACE1 (0.38) | MDM2BACE1KMT2ACASP3 | |
| SCHEMBL27527132 | 0.78 | CASP3 (0.38) | TLR2CTSKKMT2ACASP3 | |
| SCHEMBL7433227 | 0.75 | MDM2 (0.45) | MDM2TLR2KMT2ACASP3 | |
| SCHEMBL5509899 | 0.72 | SIRT2 (0.32) | MDM2BACE1CASP3 | |
| SCHEMBL5508572 | 0.72 | SIRT2 (0.32) | MDM2BACE1CASP3 | |
| SCHEMBL30759363 | 0.72 | MDM2 (0.52) | MDM2TLR2CTSK | |
| SCHEMBL5508568 | 0.71 | BACE1 (0.31) | MDM2BACE1 | |
| SCHEMBL27042592 | 0.71 | CASP3 (0.35) | BACE1KMT2ACASP3 | |
| SCHEMBL289035 | 0.70 | FABP5 (0.40) | KMT2ACASP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6187905-B1 | PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES | HOFFMANN-LA ROCHE INC. | 2001-02-13 | — | — | US | disclosed |