Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.91 |
| ▸ | CA2 | P00918 | 5/20 | 0.91 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.65 |
| ▸ | PARP1 | P09874 | 1/20 | 0.65 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.65 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | CES2 | O00748 | 2/20 | 0.64 |
| ▸ | CES1 | P23141 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | XDH | P47989 | 1/20 | 0.61 |
| ▸ | RXRA | P19793 | 1/20 | 0.60 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.56 |
| ▸ | PLK1 | P53350 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| P-Anisic Acid SCHEMBL43335 | 0.95 | CA1 (1.00) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL1157044 | 0.95 | CA1 (1.00) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL2130101 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL414716 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL29790432 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL15548197 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL17891327 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL1043957 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL846287 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 | |
| P-Anisic Acid SCHEMBL38654440 | 0.93 | CA1 (0.95) | CA1CA2PARP10PARP1PARP2 |
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-2987533-A1 | 7-substituted piperazin-1-yl fluoroquinolone compounds, their use in the treatment of cancer, pharmaceutical compositions and a method for preparation | King Saud University (SA) | 2016-02-24 | — | — | EP | disclosed |