Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | UBE2N | P61088 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 16/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL17422101 | 0.89 | HTR6 (0.50) | KDM4EUBE2NHTR6HTR2CHTR1D | |
| SCHEMBL2230089 | 0.88 | KDM4E (0.48) | KDM4EUBE2NHTR6HTR2CHTR1D | |
| SCHEMBL31298699 | 0.87 | KDM4E (0.59) | KDM4EUBE2NHTR6HTR2CHTR1D | |
| SCHEMBL2230806 | 0.86 | TGM2 (0.48) | KDM4EUBE2NHTR6CA2CA9 | |
| SCHEMBL18690941 | 0.81 | HTR6 (0.48) | KDM4EUBE2NHTR6HTR2CHTR2A | |
| SCHEMBL17422096 | 0.79 | HTR6 (0.52) | KDM4EUBE2NHTR6HTR2CHTR2A | |
| SCHEMBL17422025 | 0.75 | HTR6 (0.52) | HTR6HTR2CDRD3HTR2A | |
| SCHEMBL28510790 | 0.75 | KDM4E (0.66) | KDM4EUBE2NHTR6HTR2CHTR1D | |
| SCHEMBL28493425 | 0.75 | KDM4E (0.66) | KDM4EUBE2NHTR6HTR2CHTR1D | |
| SCHEMBL2138689 | 0.75 | KDM4E (0.66) | KDM4EUBE2NHTR6HTR2CHTR1D |
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-2011088838-A1 | NOVEL 6,6A,7,8,9,10-HEXAHYDRO-4H-4,8,10A-TRIAZA-ACEPHENANTHRYLENE DERIVATIVES AS DOPAMINE D2 LIGANDS | H. LUNDBECK A/S (DK) | 2011-07-28 | — | — | WO | disclosed |