Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | DRD1 | P21728 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | DRD5 | P21918 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL8664022 | 0.94 | TSHR (0.58) | TSHRCYP1A2CYP2A6HTR2CDRD2 | |
| SCHEMBL28666289 | 0.92 | TSHR (0.55) | TSHRCYP1A2CYP2A6HTR2CDRD2 | |
| SCHEMBL8664624 | 0.89 | TSHR (0.52) | TSHRCYP1A2CYP2A6HTR2CDRD2 | |
| SCHEMBL8666004 | 0.81 | CYP1A2 (0.56) | TSHRCYP1A2CYP2A6HTR2CDRD2 | |
| SCHEMBL4652407 | 0.74 | TSHR (0.37) | TSHRCYP1A2CYP2A6DRD2DRD1 | |
| SCHEMBL451157 | 0.74 | TSHR (0.86) | TSHRCYP2A6HTR2CDRD2DRD1 | |
| SCHEMBL3057782 | 0.74 | TSHR (0.86) | TSHRCYP2A6HTR2CDRD2DRD1 | |
| SCHEMBL9662 | 0.74 | — | — | |
| SCHEMBL29354295 | 0.74 | — | — | |
| SCHEMBL22081972 | 0.73 | CYP1A2 (0.62) | TSHRCYP1A2CYP2A6HTR2CDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992019589-A2 | LIPOXYGENASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1992-11-12 | — | — | WO | disclosed |