Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | UBE2N | P61088 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14425271 | 1.00 | CCR2 (0.53) | CCR2KCNH2CACNA1IGAACHRM4 | |
| SCHEMBL5359305 | 0.83 | KCNH2 (0.73) | CCR2KCNH2CACNA1IGAACHRM4 | |
| SCHEMBL14425272 | 0.82 | LMNA (0.45) | CCR2GAACHRM4TP53HDAC3 | |
| SCHEMBL5374660 | 0.82 | LMNA (0.45) | CCR2GAACHRM4TP53HDAC3 | |
| SCHEMBL14425270 | 0.77 | CHRM4 (0.53) | KCNH2CHRM4HDAC3HDAC4HDAC1 | |
| SCHEMBL5368709 | 0.77 | CHRM4 (0.53) | KCNH2CHRM4HDAC3HDAC4HDAC1 | |
| SCHEMBL5378277 | 0.74 | HDAC3 (0.71) | CHRM4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5368040 | 0.73 | CCR2 (0.69) | CCR2KCNH2CACNA1ICHRM4HDAC3 | |
| SCHEMBL5368811 | 0.72 | HDAC3 (0.64) | CCR2KCNH2CACNA1IGAACHRM4 | |
| SCHEMBL5365422 | 0.72 | TPSAB1 (0.63) | KCNH2CACNA1ILMNAKMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |