Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 3/20 | 0.38 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | AGXT | P21549 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7113710 | 0.83 | TSHR (0.61) | TSHRCA1CA2CA9TDP1 | |
| SCHEMBL6555604 | 0.76 | CA1 (0.48) | TSHRCA1CA2CA9MAPT | |
| SCHEMBL1081854 | 0.75 | CA2 (0.53) | TSHRCA1CA2CA9TDP1 | |
| SCHEMBL5412467 | 0.73 | CA2 (0.55) | TSHRCA1CA2CA9MAPT | |
| SCHEMBL23145745 | 0.72 | TACR1 (0.40) | TSHRCA1CA2CA9TDP1 | |
| SCHEMBL7983504 | 0.72 | CA2 (0.59) | TSHRCA1CA2CA9CA7 | |
| SCHEMBL16657622 | 0.72 | TSHR (0.56) | TSHRCA1CA2CA9CA7 | |
| SCHEMBL149658 | 0.71 | TSHR (0.61) | TSHRCA1CA2CA9TDP1 | |
| SCHEMBL20953940 | 0.71 | TSHR (0.61) | TSHRCA1CA2CA9TDP1 | |
| SCHEMBL1782352 | 0.71 | ALDH1A1 (0.49) | CA1CA2CA9TDP1KMT2A |
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-3976694-A | BETA-ADRENERGIC STIMULANT, BRONCHODILATOR | SMITHKLINE CORPORATION (US) | 1976-08-24 | — | — | US | disclosed |
| US-3961076-A | BRONCHODILATORS | SMITHKLINE CORPORATION (US) | 1976-06-01 | — | — | US | disclosed |