Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.45 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9112687 | 1.00 | CYP3A4 (0.50) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL16617490 | 0.77 | CYP3A4 (0.47) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL16617488 | 0.77 | CYP3A4 (0.47) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL16617843 | 0.77 | CYP3A4 (0.55) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL16389267 | 0.74 | CYP3A4 (0.57) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL2029772 | 0.72 | CYP3A4 (0.78) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL18793123 | 0.72 | CYP3A4 (0.55) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL2096044 | 0.71 | CYP3A4 (0.58) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL24737164 | 0.71 | CYP3A4 (0.68) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 | |
| SCHEMBL15155207 | 0.71 | ABCG2 (0.60) | CYP3A4USP2MAPK1SMN1; SMN2ABCG2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1114834-A | antidiabetic agent | OTSUKA PHARMA CO LTD (JP) | 1996-01-10 | — | — | CN | disclosed |
| EP-0670831-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-09-13 | — | — | EP | disclosed |
| WO-1995009159-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1995-04-06 | — | — | WO | disclosed |