Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CTSH | P09668 | 1/20 | 0.47 |
| ▸ | CTSC | P53634 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | MME | P08473 | 5/20 | 0.43 |
| ▸ | ACE | P12821 | 5/20 | 0.43 |
| ▸ | CPA1 | P15085 | 4/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.41 |
| ▸ | PSAT1 | Q9Y617 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14452762 | 0.88 | SIGMAR1 (0.52) | CYP1A2CYP2D6CYP3A4TAAR1MAOB | |
| SCHEMBL1752148 | 0.88 | SIGMAR1 (0.52) | CYP1A2CYP2D6CYP3A4TAAR1MAOB | |
| SCHEMBL13593628 | 0.88 | SIGMAR1 (0.52) | CYP1A2CYP2D6CYP3A4TAAR1MAOB | |
| SCHEMBL8763089 | 0.85 | ESR2 (0.42) | CYP1A2CYP3A4TAAR1MAOBALDH1A1 | |
| SCHEMBL11504701 | 0.81 | ACACB (0.48) | ACACBMMEACECPA1ACE2 | |
| SCHEMBL12669284 | 0.81 | CTSC (0.38) | CTSKCYP1A2CYP2D6CYP3A4CTSH | |
| SCHEMBL11438148 | 0.80 | LTA4H (0.52) | ACACB | |
| SCHEMBL645917 | 0.79 | FDFT1 (0.50) | TSHR | |
| Hydrochloric Acid SCHEMBL9714489 | 0.79 | SNCA (0.49) | CYP1A2CYP2D6CYP3A4TAAR1MAOB | |
| SCHEMBL26936224 | 0.78 | ACACB (0.40) | CTSKCYP1A2CYP3A4ACACBTAAR1 |
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-8486922-B2 | Composition | CHEN CHIEN-HUNG (TW) | 2013-07-16 | — | — | US | disclosed |
| US-20120183600-A1 | NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS | CHEN CHIEN-HUNG (US) | 2012-07-19 | — | — | US | disclosed |