Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 11/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 7/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.31 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.31 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19826869 | 0.86 | TSHR (0.41) | TSHRTHRBFDPSGGPS1CES2 | |
| SCHEMBL13573777 | 0.83 | TSHR (0.47) | TSHRTHRBFDPSGGPS1CES2 | |
| SCHEMBL19826867 | 0.83 | TSHR (0.39) | TSHRTHRBFDPSGGPS1CNR2 | |
| SCHEMBL14101975 | 0.83 | TSHR (0.47) | TSHRTHRBFDPSGGPS1CES2 | |
| SCHEMBL3689282 | 0.80 | — | — | |
| SCHEMBL10598536 | 0.79 | TSHR (0.42) | TSHRTHRBFDPSGGPS1CES2 | |
| SCHEMBL21185433 | 0.79 | TSHR (0.42) | TSHRTHRBFDPSGGPS1CES2 | |
| Ammonia Solution, Strong SCHEMBL829256 | 0.77 | TSHR (0.40) | TSHRTHRBFDPSGGPS1CES2 | |
| Ammonia Solution, Strong SCHEMBL324980 | 0.77 | TSHR (0.40) | TSHRTHRBFDPSGGPS1CES2 | |
| Ammonia Solution, Strong SCHEMBL9391414 | 0.77 | TSHR (0.40) | TSHRTHRBFDPSGGPS1CES2 |
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-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |