Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RGS12 | O14924 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18676726 | 0.80 | CES1 (0.61) | MAPTNPSR1CYP1A2MEN1KMT2A | |
| SCHEMBL3079295 | 0.78 | CES1 (0.63) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL31241414 | 0.78 | CES1 (0.63) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL26507159 | 0.78 | TYMS (0.41) | MAPTCYP1A2KMT2ATDP1KDM4E | |
| SCHEMBL6405656 | 0.76 | PARP1 (0.53) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL1889878 | 0.76 | PARP1 (0.55) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL9968963 | 0.74 | MEN1 (0.62) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL7278240 | 0.73 | GSK3B (0.44) | PARP1MAPTNPSR1MEN1KMT2A | |
| SCHEMBL57037 | 0.72 | DNMT1 (0.53) | PARP1MAPTNPSR1CYP1A2MEN1 | |
| SCHEMBL1654813 | 0.72 | ALOX5 (0.51) | PARP1MEN1KMT2ARECQLTDP1 |
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-2008033891-A2 | AZONAFIDE DERIVED TUMOR AND CANCER TARGETING COMPOUNDS | GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2008-03-20 | — | — | WO | disclosed |