Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | ARG1 | P05089 | 1/20 | 0.38 |
| ▸ | ARG2 | P78540 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9387826 | 0.90 | ALDH1A1 (0.45) | KDM4EALDH1A1SIGMAR1LMNACYP1A2 | |
| SCHEMBL10607328 | 0.84 | KMT2A (0.49) | KDM4EALDH1A1SIGMAR1LMNAKCNH2 | |
| SCHEMBL16829428 | 0.81 | SIGMAR1 (0.45) | KDM4ESIGMAR1LMNAHRH3SLC6A4 | |
| Hydrochloric Acid SCHEMBL15567041 | 0.77 | SIGMAR1 (0.59) | KDM4EALDH1A1SIGMAR1CYP1A2CYP2D6 | |
| SCHEMBL7304319 | 0.76 | MAOA (0.60) | KDM4EALDH1A1SIGMAR1CYP1A2CYP2D6 | |
| SCHEMBL7423105 | 0.74 | KDM4E (0.45) | KDM4EALDH1A1CYP1A2PARP1 | |
| SCHEMBL28064217 | 0.72 | HRH3 (0.43) | ALDH1A1HRH3PARP1PARP2KCNH2 | |
| SCHEMBL28252825 | 0.72 | FLT1 (0.56) | KDM4EALDH1A1LMNA | |
| SCHEMBL9386108 | 0.71 | SIGMAR1 (0.54) | KDM4EALDH1A1SIGMAR1 | |
| SCHEMBL17350872 | 0.70 | KDM4E (0.51) | KDM4EALDH1A1LMNAPARP1 |
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-1994002473-A1 | N-CYCLOALKYLPIPERAZINE DERIVATIVES, METHODS OF OBTAINING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LES LABORATOIRES MERAM (FR) | 1994-02-03 | — | — | WO | disclosed |