Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 5/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6837241 | 0.89 | LMNA (0.35) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL6837466 | 0.88 | LCK (0.36) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL369206 | 0.81 | GSK3B (0.40) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL369851 | 0.79 | GSK3A (0.40) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL370992 | 0.79 | LMNA (0.36) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL15182515 | 0.79 | MEN1 (0.42) | MAPTKDM4EALDH1A1 | |
| SCHEMBL6837254 | 0.79 | LMNA (0.36) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL366960 | 0.79 | MAPT (0.44) | LMNAMAPTSMN1; SMN2NPSR1KDM4E | |
| SCHEMBL370192 | 0.78 | MAPT (0.35) | LCKHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL369361 | 0.78 | HDAC3 (0.36) | LCKHDAC3HDAC8NCOR2ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012006760-A1 | TRICYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-19 | — | — | WO | disclosed |
| WO-2012008999-A2 | TRICYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-19 | — | — | WO | disclosed |