Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL79567 | 0.79 | TSHR (0.59) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL27902057 | 0.79 | TSHR (0.59) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL123557 | 0.75 | TSHR (1.00) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL14365914 | 0.75 | TSHR (1.00) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL11329652 | 0.75 | TSHR (0.73) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL23611735 | 0.75 | TSHR (1.00) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| Water SCHEMBL9947734 | 0.74 | ALDH1A1 (0.65) | TSHRALDH1A1CYP3A4TDP1CA2 | |
| SCHEMBL8309457 | 0.73 | ALDH1A1 (0.52) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL11081202 | 0.73 | TSHR (0.62) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL681479 | 0.73 | TSHR (0.70) | TSHRALDH1A1CYP3A4TDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4992200-A | Of silver and gold as complexes of a guanidine compoumd | HENKEL CORPORATION (US) | 1991-02-12 | — | — | US | disclosed |
| US-4895597-A | ION EXCHANGE WITH GUANIDINE FUNCTIONALITY | HENKEL CORPORATION (US) | 1990-01-23 | — | — | US | disclosed |
| US-4814007-A | SOLVENT EXTRACTION, GUANIDINE COMPOUND | HENKEL CORPORATION (US) | 1989-03-21 | — | — | US | disclosed |