Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.43 |
| ▸ | LTA4H | P09960 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | PSMB1 | P20618 | 3/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.42 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL7549907 | 0.83 | HRH3 (0.47) | HRH3LTA4HKDM4EPSMB1PSMB5 | |
| SCHEMBL7554518 | 0.77 | HRH3 (0.53) | HRH3LTA4H | |
| SCHEMBL7117592 | 0.74 | LTA4H (0.60) | HRH3LTA4HDRD3KCNH2HRH1 | |
| SCHEMBL3434009 | 0.72 | HRH3 (0.48) | HRH3LTA4HKCNH2 | |
| SCHEMBL28039148 | 0.69 | LMNA (0.43) | — | |
| SCHEMBL4599631 | 0.66 | MEN1 (0.53) | KDM4E | |
| SCHEMBL8542490 | 0.66 | MEN1 (0.53) | KDM4E | |
| SCHEMBL16409420 | 0.65 | TDP1 (0.48) | KDM4E | |
| SCHEMBL21427 | 0.65 | NQO1 (0.47) | LTA4H | |
| SCHEMBL4045684 | 0.65 | MEN1 (0.45) | — |
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-1280774-A1 | SUBSTITUTED INDOLES AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2003-02-05 | — | — | EP | disclosed |
| EP-1183259-A2 | AZEPINOINDOLE DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-06 | — | — | EP | disclosed |
| WO-2001085687-A1 | SUBSTITUTED INDOLES AS PARP INHIBITORS | BASF AG (DE) | 2001-11-15 | — | — | WO | disclosed |
| WO-2001023390-A2 | AZEPINOINDOLE DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2001-04-05 | — | — | WO | disclosed |