Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 4/20 | 0.54 |
| ▸ | CTSS | P25774 | 4/20 | 0.54 |
| ▸ | CTSL | P07711 | 3/20 | 0.54 |
| ▸ | CAPN1 | P07384 | 4/20 | 0.51 |
| ▸ | CTSK | P43235 | 4/20 | 0.48 |
| ▸ | CASP3 | P42574 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7512644 | 1.00 | MEN1 (0.55) | MEN1KMT2ALMNACTSBCTSS | |
| SCHEMBL7517242 | 0.92 | CAPN1 (0.58) | CTSBCTSSCTSLCAPN1CTSK | |
| SCHEMBL7514777 | 0.92 | CAPN1 (0.58) | CTSBCTSSCTSLCAPN1CTSK | |
| SCHEMBL7517386 | 0.91 | CTSS (0.56) | MEN1KMT2ALMNACTSBCTSS | |
| SCHEMBL7517379 | 0.91 | CTSS (0.56) | MEN1KMT2ALMNACTSBCTSS | |
| SCHEMBL8810051 | 0.87 | CAPN1 (0.66) | MEN1KMT2ALMNACTSBCTSS | |
| SCHEMBL3577128 | 0.84 | CTSK (0.62) | CTSBCTSSCTSLCAPN1CTSK | |
| SCHEMBL8406499 | 0.84 | CTSK (0.62) | CTSBCTSSCTSLCAPN1CTSK | |
| SCHEMBL7514109 | 0.84 | CTSK (0.62) | CTSBCTSSCTSLCAPN1CTSK | |
| SCHEMBL7514113 | 0.84 | CTSK (0.59) | CTSBCTSSCTSLCTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641800-B1 | Lactol derivatives as inhibitors of cathepsin L | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-01-16 | — | — | EP | disclosed |
| US-5496834-A | PEPTIDE DERIVATIVES AS CATHEPSIN L INHIBITORS AND INHIBITORS OF BONE RESORPTION OR TREATMENT OF OSTEOPOROSIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0641800-A1 | Lactol derivatives as inhibiters of cathepsin L | Takeda Chemical Industries, Ltd. (JP) | 1995-03-08 | — | — | EP | disclosed |