Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8960400 | 1.00 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL9838029 | 0.83 | LMNA (0.42) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL4936612 | 0.80 | MEN1 (0.44) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL14778954 | 0.80 | MEN1 (0.44) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL6916220 | 0.79 | MEN1 (0.44) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL29223429 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL8823314 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP2C9CYP2C19KMT2AGAA | |
| SCHEMBL9079856 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP2C9CYP2C19KMT2AGAA | |
| SCHEMBL6907022 | 0.79 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 | |
| SCHEMBL7630224 | 0.78 | KMT2A (0.43) | CYP1A2CYP2C9CYP2C19KMT2AMEN1 |
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-0441979-B1 | OPTICALLY ACTIVE 2-(ALKYL-SUBSTITUTED PHENYL)-PROPIONIC ACID DERIVATIVE AND OPTICAL RESOLUTION OF ( )-1-METHYL-3-PHENYLPROPYLAMINE | DAICEL CHEM (JP) | 1996-01-31 | — | — | EP | disclosed |
| EP-0441979-A1 | OPTICALLY ACTIVE 2-(ALKYL-SUBSTITUTED PHENYL)-PROPIONIC ACID DERIVATIVE AND OPTICAL RESOLUTION OF ( )-1-METHYL-3-PHENYLPROPYLAMINE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1991-08-21 | — | — | EP | disclosed |
| US-4552977-A | Process for the preparation of (phenoxy- or benzyl-)-phenoxypropionic acids and their alkali metal salts | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-11-12 | — | — | US | disclosed |