Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.45 |
| ▸ | PTAFR | P25105 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10044952 | 0.85 | PTAFR (0.39) | BRD4PTAFRTUBB1ERN1CYP1A2 | |
| SCHEMBL15180052 | 0.83 | CA1 (0.39) | BRD4PTAFRTUBB1ERN1CYP1A2 | |
| SCHEMBL10044441 | 0.83 | BRD4 (0.40) | BRD4PTAFRL3MBTL1CYP1A2 | |
| SCHEMBL10044605 | 0.82 | BRD4 (0.55) | BRD4L3MBTL1TUBB1CYP1A2PTPN1 | |
| SCHEMBL18639409 | 0.79 | MAPK1 (0.47) | BRD4L3MBTL1CYP1A2PTPN1 | |
| SCHEMBL10044942 | 0.77 | BRD4 (0.48) | BRD4L3MBTL1TUBB1CYP1A2PTPN1 | |
| SCHEMBL10044445 | 0.77 | LMNA (0.48) | BRD4CYP1A2PTPN1 | |
| SCHEMBL16448973 | 0.72 | BRD4 (0.53) | BRD4TUBB1CYP1A2S1PR1S1PR3 | |
| SCHEMBL10044945 | 0.71 | L3MBTL1 (0.45) | BRD4L3MBTL1CYP1A2PTPN1ELANE | |
| SCHEMBL10044524 | 0.69 | BRD4 (0.38) | BRD4L3MBTL1CYP1A2PTPN1 |
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-2012052420-A1 | METHOD FOR PREPARING SUBSTITUTED N-(3-AMINO-QUINOXALIN-2-YL)-SULFONAMIDES AND THEIR INTERMEDIATES N-(3-CHLORO-QUINOXALIN-2-YL)SULFONAMIDES | MERCK SERONO S.A. GENEVA (CH) | 2012-04-26 | — | — | WO | disclosed |