Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MLYCD | O95822 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11520173 | 0.81 | CA2 (0.36) | CA2CNR1ESR1KCNH2ALDH1A1 | |
| SCHEMBL11522600 | 0.75 | ALDH1A1 (0.35) | CA2ALDH1A1SMN1; SMN2 | |
| SCHEMBL958597 | 0.74 | CA2 (0.46) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL865062 | 0.72 | CA2 (0.43) | CA2CNR1ESR1KCNH2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29891850 | 0.72 | MLYCD (0.44) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL7219098 | 0.72 | CA2 (0.43) | CA2CNR1ESR1KCNH2ALDH1A1 | |
| SCHEMBL836707 | 0.71 | CA2 (0.39) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL5532725 | 0.71 | CA2 (0.39) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL5532723 | 0.71 | CA2 (0.39) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL25135055 | 0.70 | TAS1R3 (0.46) | CA2ESR1KCNH2ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4170641-A | 1-N-(ω-aminoalkanesulfonyl) derivative of aminoglycosidic antibiotic and process for preparation thereof | MEIJI SEIKA KAISHA, LTD. (JP) | 1979-10-09 | — | — | US | disclosed |