Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11284982 | 0.81 | CA12 (0.42) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL65107 | 0.80 | CA12 (0.61) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11495809 | 0.78 | CA12 (0.51) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11030968 | 0.78 | ALDH1A1 (0.41) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11442183 | 0.78 | CA12 (0.40) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11038372 | 0.77 | CA12 (0.42) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11442446 | 0.77 | CA12 (0.39) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL264830 | 0.76 | CA12 (0.57) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL708934 | 0.76 | CA12 (0.57) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL5851951 | 0.76 | CA1 (0.57) | CA12CA1CA2CA9ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4435204-A | N-Organo-phosphonomethylglycine-N-oxides and the use thereof to increase the sucrose content of sugarcane | MONSANTO COMPANY (US) | 1984-03-06 | — | — | US | disclosed |
| US-4131448-A | HERBICIDE | MONSANTO COMPANY (US) | 1978-12-26 | — | — | US | disclosed |
| US-4130412-A | HERBICIDE | MONSANTO COMPANY (US) | 1978-12-19 | — | — | US | disclosed |