Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 3/20 | 0.35 |
| ▸ | MMP8 | P22894 | 3/20 | 0.35 |
| ▸ | MMP13 | P45452 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10653026 | 0.89 | TDP1 (0.45) | VCAM1TDP1L3MBTL1TSHRALDH1A1 | |
| SCHEMBL10649978 | 0.78 | MAPK1 (0.46) | TDP1L3MBTL1TSHRNPC1SMN1; SMN2 | |
| SCHEMBL4815935 | 0.77 | TDP1 (0.54) | TDP1L3MBTL1TSHRNPC1SMN1; SMN2 | |
| SCHEMBL10652756 | 0.77 | VCAM1 (0.49) | VCAM1TDP1L3MBTL1TSHRNPC1 | |
| SCHEMBL10654440 | 0.76 | MAPK1 (0.45) | TDP1L3MBTL1TSHRGAAALDH1A1 | |
| SCHEMBL10873353 | 0.75 | ALDH1A1 (0.47) | TDP1L3MBTL1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL10652053 | 0.71 | KMT2A (0.52) | TDP1L3MBTL1GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL10650928 | 0.70 | KMT2A (0.51) | VCAM1TDP1L3MBTL1TSHRALDH1A1 | |
| SCHEMBL10650939 | 0.70 | KMT2A (0.51) | VCAM1TDP1L3MBTL1TSHRALDH1A1 | |
| SCHEMBL2257980 | 0.70 | TDP1 (0.64) | TDP1L3MBTL1TSHRNPC1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0197386-B1 | 2-(SUBSTITUTED SULFAMYL) DERIVATIVES OF 6-NITROBENZOIC ACID, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1988-11-02 | — | — | EP | claimed |