Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 11/20 | 0.33 |
| ▸ | CES2 | O00748 | 4/20 | 0.33 |
| ▸ | CES1 | P23141 | 8/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27810338 | 0.82 | MEN1 (0.39) | FAAHCES2CES1MEN1CYP1A2 | |
| SCHEMBL1082749 | 0.81 | CYP3A4 (0.41) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL11233126 | 0.79 | CYP3A4 (0.39) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| SCHEMBL28427366 | 0.79 | CYP3A4 (0.39) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| SCHEMBL11444238 | 0.79 | CYP3A4 (0.39) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| SCHEMBL28761387 | 0.79 | CYP3A4 (0.39) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| SCHEMBL29506833 | 0.79 | CYP3A4 (0.39) | TSHRMEN1KMT2AHSD17B10CYP3A4 | |
| Trifluoroacetic Acid SCHEMBL28119416 | 0.76 | CYP3A4 (0.37) | TSHRHSD17B10CYP3A4 | |
| SCHEMBL19105318 | 0.76 | TSHR (0.49) | TSHRHPGDFAAHCES2CES1 | |
| SCHEMBL28292315 | 0.74 | MAPK1 (0.38) | TSHRCYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104176393-B | Pressurized delivered container, the keeping method for having used it and liquid relief method | 中央硝子株式会社 | 2018-03-16 | — | — | CN | disclosed |