Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | COMT | P21964 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | METAP1 | P53582 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9181528 | 0.83 | PARP1 (0.57) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL20677857 | 0.79 | HTT (0.58) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL12899533 | 0.79 | PARP1 (0.51) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL30553881 | 0.77 | KDM4E (0.59) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL19036261 | 0.77 | HDAC6 (0.50) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL9268910 | 0.77 | MMP2 (0.48) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL3711541 | 0.77 | KDM4E (0.59) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL9268906 | 0.76 | HDAC6 (0.49) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL895544 | 0.76 | MMP2 (0.54) | PARP1MMP2TSHRCHRM1COMT | |
| SCHEMBL30003476 | 0.76 | TSHR (0.55) | PARP1MMP2TSHRCHRM1COMT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1347978-B1 | NOVEL SUBSTITUTED IMIDAZOTRIAZINONES AS PDE II-INHIBITORS | BAYER HEALTHCARE AG (DE) | 2005-08-31 | — | — | EP | disclosed |
| EP-1347978-A1 | NOVEL SUBSTITUTED IMIDAZOTRIAZINONES AS PDE II-INHIBITORS | Bayer Aktiengesellschaft (DE) | 2003-10-01 | — | — | EP | disclosed |
| WO-2002050078-A1 | NOVEL SUBSTITUTED IMIDAZOTRIAZINONES AS PDE II-INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-27 | — | — | WO | disclosed |