Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL28597552 | 0.92 | TSHR (0.42) | TSHRANPEPADRB2ADRB1ADRB3 | |
| SCHEMBL50477 | 0.92 | — | — | |
| SCHEMBL28009351 | 0.90 | — | — | |
| Methyl Alcohol SCHEMBL3935368 | 0.90 | TSHR (0.40) | TSHRANPEPADRB2ADRB1ADRB3 | |
| Alcohol SCHEMBL28122272 | 0.87 | TSHR (0.44) | TSHRANPEPADRB2ADRB1ADRB3 | |
| SCHEMBL170051 | 0.84 | — | — | |
| Tetrabuthylammonium SCHEMBL21051081 | 0.84 | SLC22A1 (0.52) | TSHRALDH1A1CYP3A4 | |
| Tetramethylammonium Ion SCHEMBL8050138 | 0.83 | TSHR (0.36) | TSHRANPEPADRB2ADRB1ADRB3 | |
| SCHEMBL23302194 | 0.82 | THRB (0.44) | TSHRALDH1A1CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL2792659 | 0.82 | CA12 (0.39) | TSHRANPEPCA1CA2 |
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-6057078-A | PHOTOGRAPHY | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2000-05-02 | — | — | US | disclosed |
| US-5807905-A | POLYMERIZATION OF UNSATURATED COMPOUNDS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-09-15 | — | — | US | disclosed |