Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 8/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.35 |
| ▸ | TLR2 | O60603 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6632980 | 0.87 | ALDH1A1 (0.41) | PTPN1PTPN2ALDH1A1 | |
| SCHEMBL6062639 | 0.86 | CASP1 (0.34) | PTPN1PTPN2ALDH1A1MTNR1AMTNR1B | |
| SCHEMBL6062634 | 0.86 | CASP1 (0.34) | PTPN1PTPN2ALDH1A1MTNR1AMTNR1B | |
| SCHEMBL6063534 | 0.86 | CTSS (0.38) | PTPN1PTPN2ALDH1A1 | |
| SCHEMBL6632750 | 0.86 | ALDH1A1 (0.39) | PTPN1PTPN2ALDH1A1PTGER4 | |
| SCHEMBL6630204 | 0.86 | ALDH1A1 (0.39) | PTPN1PTPN2ALDH1A1PTGER4 | |
| SCHEMBL6632745 | 0.86 | ALDH1A1 (0.39) | PTPN1PTPN2ALDH1A1PTGER4 | |
| SCHEMBL6628449 | 0.85 | MAPT (0.46) | PTPN1ALDH1A1KMT2AHPGD | |
| SCHEMBL6061712 | 0.85 | MAPT (0.46) | PTPN1ALDH1A1KMT2AHPGD | |
| SCHEMBL6062952 | 0.85 | DAGLA (0.52) | ALDH1A1MTNR1AMTNR1BFAAHCES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1397340-A2 | CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2004-03-17 | — | — | EP | disclosed |
| WO-2002098850-A2 | CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-12-12 | — | — | WO | disclosed |