Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.50 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6549557 | 0.92 | ATM (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL8603038 | 0.92 | ATM (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL9301967 | 0.92 | ATM (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL11406714 | 0.92 | ATM (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| Hydrochloric Acid SCHEMBL9492789 | 0.91 | ATM (0.56) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL7999080 | 0.89 | MME (0.54) | — | |
| SCHEMBL27516456 | 0.89 | MME (0.54) | — | |
| SCHEMBL8085197 | 0.88 | ALDH1A1 (0.60) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL10347067 | 0.87 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL10868030 | 0.87 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0510552-B2 | Preparation process of alpha-aspartyl-L-phenylalanine methyl ester | MITSUI TOATSU CHEMICALS (JP) | 2000-11-15 | — | — | EP | disclosed |
| US-5424477-A | Preparation process of α-aspartyl-L-phenylalanine methyl ester | MITSUI TOATSU CHEMICALS INCORPORATED (JP) | 1995-06-13 | — | — | US | disclosed |
| US-5347035-A | Purification | TOSOH CORPORATION (JP) | 1994-09-13 | — | — | US | disclosed |
| EP-0510552-A1 | Preparation process of alpha-aspartyl-L-phenylalanine methyl ester | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1992-10-28 | — | — | EP | disclosed |