Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8773620 | 0.90 | SMN1; SMN2 (0.48) | SMN1; SMN2GLAHSD17B10ALDH1A1CA12 | |
| SCHEMBL9442610 | 0.88 | KDM4E (0.45) | SMN1; SMN2GLAHSD17B10CA12CA1 | |
| Bicarbonate SCHEMBL28061158 | 0.87 | SMN1; SMN2 (0.46) | SMN1; SMN2GLAHSD17B10ALDH1A1CA12 | |
| Acetic Acid SCHEMBL5163643 | 0.87 | SMN1; SMN2 (0.52) | SMN1; SMN2GLAHSD17B10ALDH1A1CA12 | |
| Hydrogen Peroxide SCHEMBL11793831 | 0.87 | — | — | |
| SCHEMBL7093958 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2GLAHSD17B10ALDH1A1CA12 | |
| Propionic Acid SCHEMBL25192953 | 0.81 | GLA (0.50) | SMN1; SMN2GLAHSD17B10ALDH1A1TSHR | |
| SCHEMBL16569982 | 0.81 | ALDH1A1 (0.44) | SMN1; SMN2GLAHSD17B10ALDH1A1TSHR | |
| Methyl Alcohol SCHEMBL28612959 | 0.81 | — | — | |
| SCHEMBL10001930 | 0.81 | CA12 (0.45) | SMN1; SMN2GLAALDH1A1CA12CA1 |
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-5280119-A | Heterocyclic amine attached to boron by a nitrogen-boron coordinated bond | BORON BIOLOGICALS, INC. (US) | 1994-01-18 | — | — | US | disclosed |
| WO-1993009123-A1 | HETEROCYCLIC AMINO-BORANES | BORON BIOLOGICALS, INC. (US) | 1993-05-13 | — | — | WO | disclosed |