Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.39 |
| ▸ | CTSC | P53634 | 7/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7981994 | 0.87 | TSHR (0.37) | TSHRCTSKDRD2CTSDBACE1 | |
| SCHEMBL6952234 | 0.81 | MAOB (0.44) | CTSK | |
| SCHEMBL7981046 | 0.81 | MMP13 (0.42) | TSHREPHX2 | |
| SCHEMBL7983717 | 0.80 | CTSS (0.55) | TSHRCTSKCHRM2CHRM3 | |
| SCHEMBL7983723 | 0.80 | CTSS (0.55) | TSHRCTSKCHRM2CHRM3 | |
| SCHEMBL6952090 | 0.79 | ADORA1 (0.46) | — | |
| SCHEMBL7987630 | 0.76 | MEN1 (0.37) | TSHREPHX1DRD2CTSDBACE1 | |
| SCHEMBL18930483 | 0.75 | DRD2 (0.48) | TSHREPHX1CTSKDRD2 | |
| SCHEMBL21144920 | 0.75 | DRD2 (0.48) | TSHREPHX1CTSKDRD2 | |
| SCHEMBL18930479 | 0.75 | DRD2 (0.48) | TSHREPHX1CTSKDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6284912-B1 | Process for synthesizing para-and/or meta-substituted cyanophenyalanine derivatives | LG CHEMICAL, LTD. (KR) | 2001-09-04 | — | — | US | disclosed |
| EP-1043309-A1 | Process for synthesizing para-and/or meta-substituted cyanophenylalanine derivatives | LG Chemical Ltd. (KR) | 2000-10-11 | — | — | EP | disclosed |