Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.59 |
| ▸ | CRHBP | P24387 | 1/20 | 0.59 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | NSD2 | O96028 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.51 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL731102 | 0.98 | MCOLN3 (0.60) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL28777156 | 0.96 | MCOLN3 (0.59) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL9568275 | 0.96 | MCOLN3 (0.59) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL11745901 | 0.84 | TSHR (0.54) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL11745892 | 0.84 | TSHR (0.54) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL10744526 | 0.83 | MCOLN3 (0.50) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| Hydrogen Peroxide SCHEMBL28682950 | 0.82 | TSHR (0.57) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL10477302 | 0.81 | NSD2 (0.59) | MCOLN3CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL10700954 | 0.81 | MCOLN3 (0.58) | MCOLN3CRHBPCRHR2ALDH1A1TSHR | |
| SCHEMBL29397077 | 0.81 | MCOLN3 (0.58) | MCOLN3CRHBPCRHR2ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0534360-A1 | Method of preparing nitrotoluenesulfonic acids and sodium salts thereof | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-03-31 | — | — | EP | claimed |
| EP-0534360-A1 | Method of preparing nitrotoluenesulfonic acids and sodium salts thereof | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-03-31 | — | — | EP | disclosed |