Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GSTP1 | P09211 | 7/20 | 0.33 |
| ▸ | GSTM2 | P28161 | 5/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.32 |
| ▸ | LIG1 | P18858 | 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 | |
|---|---|---|---|---|
| SCHEMBL27893811 | 0.79 | CA12 (0.37) | CA12CA1CA2CA9KMT2A | |
| Methyl Alcohol SCHEMBL27893750 | 0.79 | KMT2A (0.35) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL28904008 | 0.79 | GSTP1 (0.38) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL28735938 | 0.78 | CA12 (0.36) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL29164396 | 0.71 | — | — | |
| SCHEMBL2890927 | 0.70 | CA12 (0.55) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL29088214 | 0.69 | CA12 (0.53) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL29005813 | 0.67 | KMT2A (0.42) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL30281150 | 0.65 | CA12 (0.39) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL2889879 | 0.65 | CA12 (0.39) | CA12CA1CA2CA9KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102702131-A | Method for synthesizing plasticizer 3-nitro furazan-4-methyl ether | TAICANG XINXING LIGHT INDUSTRY AUX IES FACTORY | 2012-10-03 | — | — | CN | disclosed |