Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.61 |
| ▸ | CTSL | P07711 | 4/20 | 0.60 |
| ▸ | CTSB | P07858 | 2/20 | 0.60 |
| ▸ | CTSS | P25774 | 1/20 | 0.60 |
| ▸ | CTSK | P43235 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | TACR1 | P25103 | 2/20 | 0.58 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | KYNU | Q16719 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL27395816 | 1.00 | ALDH1A1 (0.62) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL240653 | 1.00 | ALDH1A1 (0.62) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL9402445 | 1.00 | ALDH1A1 (0.62) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL9862186 | 0.95 | CASP3 (0.61) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL11059021 | 0.93 | CTSL (0.60) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL10868800 | 0.93 | CAPN1 (0.59) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL10347011 | 0.93 | CAPN1 (0.59) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL9545976 | 0.92 | CTSL (0.69) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL5303963 | 0.92 | ALDH1A1 (0.61) | ALDH1A1ALOX15CAPN1CTSLCTSB | |
| SCHEMBL27523222 | 0.92 | ALDH1A1 (0.61) | ALDH1A1ALOX15CAPN1CTSLCTSB |
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-0334236-B1 | Preparation of n-protected alpha-l-aspartyl-l-phenylalanine methyl ester | MITSUI TOATSU CHEMICALS (JP) | 1994-08-31 | — | — | EP | disclosed |
| US-5302743-A | Reacting N-protected L-aspartic anhydride with L-phenylalanine methyl ester salt in non-aqueous solvent | MITSUI TOATSU CHEMICALS, INC. (JP) | 1994-04-12 | — | — | US | disclosed |
| EP-0334236-A2 | Preparation of n-protected alpha-l-aspartyl-l-phenylalanine methyl ester | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1989-09-27 | — | — | EP | disclosed |