Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | RBP4 | P02753 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL28223258 | 0.83 | ALDH1A1 (0.45) | CYP2C9GAAL3MBTL1ALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL2710119 | 0.82 | CYP2C9 (0.44) | CYP2C9GAAL3MBTL1ALDH1A1ALOX15 | |
| Benzoic Acid SCHEMBL29142624 | 0.78 | TSHR (0.44) | CYP2C9GAAL3MBTL1ALDH1A1ALOX15 | |
| SCHEMBL2365661 | 0.72 | METAP2 (0.43) | GAAALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL2710116 | 0.70 | ALDH1A1 (0.41) | GAAALDH1A1ALOX15KDM4EHPGD | |
| SCHEMBL10011881 | 0.70 | SCN9A (0.37) | GAAALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL27943561 | 0.70 | MMP2 (0.47) | CYP2C9GAAL3MBTL1ALDH1A1ALOX15 | |
| SCHEMBL28731873 | 0.70 | MAPT (0.47) | CYP2C9GAAALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL1670564 | 0.70 | CYP2C9 (0.51) | CYP2C9ALDH1A1ALOX15KDM4ECYP3A4 | |
| SCHEMBL5834541 | 0.68 | ALDH1A1 (0.41) | GAAL3MBTL1ALDH1A1ALOX15KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1367046-A9 | Disubstituted lavendustin A analogs and pharmaceutical compositions comprising the analogs | THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2004-05-12 | — | — | EP | disclosed |
| EP-1367046-A1 | Disubstituted lavendustin A analogs and pharmaceutical compositions comprising the analogs | THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2003-12-03 | — | — | EP | disclosed |
| EP-1060160-A2 | DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS | THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999043636-A2 | DISUBSTITUTED LAVENDUSTIN A ANALOGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ANALOGS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THESECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1999-09-02 | — | — | WO | disclosed |