Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | SPR | P35270 | 1/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.41 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | TACR3 | P29371 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7106093 | 0.90 | ERCC1 (0.48) | CYP2C19MMP1MMP2MMP9EPHX1 | |
| SCHEMBL7103182 | 0.78 | NR1H2 (0.43) | CYP3A4CYP2C19MMP1MMP2MMP9 | |
| SCHEMBL7442260 | 0.71 | CYP2C19 (0.55) | CYP3A4CYP2C19MMP1MMP2EPHX1 | |
| SCHEMBL7103185 | 0.71 | OPRK1 (0.54) | CYP3A4CYP2C19MMP1MMP2MMP9 | |
| SCHEMBL11230906 | 0.70 | ADRB2 (0.44) | CYP2C19ERCC1ERCC4NPC1RAB9A | |
| SCHEMBL7106096 | 0.68 | ERCC1 (0.42) | CYP3A4CYP2C19MMP1MMP2MMP9 | |
| SCHEMBL28863035 | 0.68 | EPHX1 (0.56) | CYP3A4CYP2C19MMP1MMP2EPHX1 | |
| SCHEMBL9328648 | 0.68 | GAA (0.63) | SLC6A5BCHEOPRK1 | |
| SCHEMBL2749289 | 0.68 | SPR (0.63) | MMP1MMP2MMP9SLC6A5SPR | |
| SCHEMBL7436079 | 0.68 | KDM4E (0.53) | CYP3A4CYP2C19MMP1MMP2MMP9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1055665-B1 | 3-(3-Hydroxyphenyl)-3-amino-propionamide derivatives | PFIZER PROD INC (US) | 2003-10-22 | — | — | EP | disclosed |
| EP-1055665-A1 | 3-(3-Hydroxyphenyl)-3-amino-propionamide derivatives | Pfizer Products Inc. (US) | 2000-11-29 | — | — | EP | disclosed |