Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL10690669 | 0.84 | CNOT7 (0.41) | TSHRHSP90AA1HSP90B1HPGDTAAR1 | |
| SCHEMBL10692003 | 0.81 | TAAR1 (0.42) | TSHRHSP90AA1HSP90B1HPGDTAAR1 | |
| SCHEMBL27528035 | 0.80 | HSP90AA1 (0.46) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL9369579 | 0.78 | ALDH1A1 (0.40) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL10556011 | 0.78 | HSP90AA1 (0.47) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL10691914 | 0.76 | HSP90AA1 (0.41) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL28420210 | 0.75 | HSP90AA1 (0.45) | TSHRALDH1A1HSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10556844 | 0.74 | HSP90AA1 (0.40) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL10555867 | 0.74 | HSP90AA1 (0.42) | TSHRALDH1A1HSP90AA1HSP90B1HTT | |
| SCHEMBL10555876 | 0.74 | HSP90AA1 (0.44) | TSHRALDH1A1HSP90AA1HSP90B1L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0274434-A1 | Dopamine-beta-hydroxylase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1988-07-13 | — | — | EP | claimed |
| US-4749717-A | 1-(2- OR 3-THIENYLALKYL)IMIDAZOLE-2-THIOLS AND 1-(2- OR 3-THIENYLALKYL)-2-ALKLYTHIOMIDAZOLES; HYPOTENSIVE AGENT, DIURETIC | SMITHKLINE BECKMAN CORPORATION (US) | 1988-06-07 | — | — | US | claimed |
| EP-0274434-A1 | Dopamine-beta-hydroxylase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1988-07-13 | — | — | EP | disclosed |
| US-4749717-A | 1-(2- OR 3-THIENYLALKYL)IMIDAZOLE-2-THIOLS AND 1-(2- OR 3-THIENYLALKYL)-2-ALKLYTHIOMIDAZOLES; HYPOTENSIVE AGENT, DIURETIC | SMITHKLINE BECKMAN CORPORATION (US) | 1988-06-07 | — | — | US | disclosed |