Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.96 |
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | SHBG | P04278 | 1/20 | 0.59 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 3/20 | 0.58 |
| ▸ | CA1 | P00915 | 3/20 | 0.58 |
| ▸ | CA2 | P00918 | 3/20 | 0.58 |
| ▸ | CA7 | P43166 | 3/20 | 0.58 |
| ▸ | CA9 | Q16790 | 3/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL481085 | 0.98 | HSP90AB1 (1.00) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL29457585 | 0.98 | HSP90AB1 (1.00) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL4706474 | 0.98 | HSP90AB1 (1.00) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL28055636 | 0.92 | HSP90AB1 (0.89) | HSP90AB1HTTESR1SHBGESR2 | |
| Propionaldehyde SCHEMBL28055637 | 0.89 | HSP90AB1 (0.83) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL3662473 | 0.82 | HTT (0.77) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL31166012 | 0.82 | HTT (0.77) | HSP90AB1HTTESR1SHBGESR2 | |
| SCHEMBL1129352 | 0.82 | HSP90AB1 (0.71) | HSP90AB1HTTESR1ESR2CA12 | |
| SCHEMBL29457562 | 0.82 | HSP90AB1 (0.71) | HSP90AB1HTTESR1ESR2CA12 | |
| SCHEMBL6427459 | 0.81 | HSP90AB1 (0.70) | HSP90AB1HTTESR1SHBGESR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105254512-B | Preparation method of terbutaline sulphate | 山东达因海洋生物制药股份有限公司 | 2017-03-22 | — | — | CN | disclosed |
| CN-105254512-A | Preparation method of terbutaline sulphate | SHANDONG DYNE MARINE BIOTECHNOLOGICAL PHARM HOLDINGS CO LTD | 2016-01-20 | — | — | CN | disclosed |