Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL858078 | 0.84 | — | — | |
| SCHEMBL18867261 | 0.84 | — | — | |
| SCHEMBL16343058 | 0.82 | SMN1; SMN2 (0.44) | TSHRSMN1; SMN2CA14KMT2ACA12 | |
| Dimethylformamide SCHEMBL2230120 | 0.80 | ALDH1A1 (0.42) | TSHRSMN1; SMN2KMT2ACA12ALDH1A1 | |
| SCHEMBL27485803 | 0.75 | SMN1; SMN2 (0.42) | TSHRSMN1; SMN2CA14KMT2ACA12 | |
| Dimethylformamide SCHEMBL18338733 | 0.74 | ALDH1A1 (0.59) | TSHRKMT2AALDH1A1MEN1 | |
| Dimethylformamide SCHEMBL7693280 | 0.72 | TSHR (0.35) | TSHRSMN1; SMN2CA14KMT2AALDH1A1 | |
| SCHEMBL275280 | 0.71 | SMN1; SMN2 (0.52) | TSHRSMN1; SMN2CA14KMT2ACA12 | |
| SCHEMBL20993244 | 0.70 | SMN1; SMN2 (0.38) | TSHRSMN1; SMN2CA14KMT2ACA12 | |
| Dimethylformamide SCHEMBL28192559 | 0.69 | TSHR (0.53) | TSHRKMT2AALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011090323-A2 | NOVEL PREPARATION METHOD OF 2-(2-N-BUTYL-4-HYDROXY-6-METHYL-PYRIMIDIN-5-YL)-N,N-DIMETHYLACETAMIDE | BORYUNG PHARMACEUTICAL CO., LTD (KR) | 2011-07-28 | — | — | WO | disclosed |