Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 10/20 | 0.60 |
| ▸ | CTSK | P43235 | 3/20 | 0.54 |
| ▸ | TACR1 | P25103 | 2/20 | 0.54 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.54 |
| ▸ | CTSL | P07711 | 1/20 | 0.53 |
| ▸ | CTSB | P07858 | 1/20 | 0.53 |
| ▸ | CTSS | P25774 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL8765627 | 1.00 | CASP1 (0.60) | CASP1CTSKTACR1CTRB1CTSL | |
| SCHEMBL5405717 | 0.92 | CASP1 (0.52) | CASP1CTSKTACR1CTRB1CTSL | |
| SCHEMBL25491977 | 0.91 | MMP9 (0.52) | CASP1CTSKTACR1CTSLCTSB | |
| SCHEMBL2912589 | 0.91 | CASP1 (0.60) | CASP1CTSKTACR1CTRB1CTSL | |
| SCHEMBL2912586 | 0.91 | CASP1 (0.60) | CASP1CTSKTACR1CTRB1CTSL | |
| SCHEMBL7583002 | 0.91 | CASP1 (0.60) | CASP1CTSKTACR1CTRB1CTSL | |
| SCHEMBL28709501 | 0.89 | ALDH1A1 (0.53) | CASP1TACR1CTRB1ALDH1A1 | |
| SCHEMBL4280669 | 0.89 | CASP1 (0.67) | CASP1 | |
| SCHEMBL4280674 | 0.89 | CASP1 (0.67) | CASP1 | |
| SCHEMBL14177313 | 0.89 | ALDH1A1 (0.53) | CASP1CTSKTACR1ALDH1A1 |
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-5279946-A | Process for the preparation of N-benzyloxycarbonyl-alpha-L-aspartyl-L-phenylalanine methyl ester | DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) | 1994-01-18 | — | — | US | disclosed |