Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | BTN3A1 | O00481 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | PTGIR | P43119 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7307231 | 0.82 | CYP2C19 (0.38) | FFAR4CYP2C19HIF1AESR1MAPT | |
| SCHEMBL7306684 | 0.82 | BACE1 (0.31) | BACE1 | |
| SCHEMBL7313272 | 0.73 | LMNA (0.42) | TBXAS1 | |
| SCHEMBL7308333 | 0.73 | ADRA1A (0.40) | CYP2C19HIF1AMAPTRXFP1HDAC3 | |
| SCHEMBL7313549 | 0.70 | PTGER4 (0.39) | CYP2C19HIF1AMAPTRXFP1 | |
| SCHEMBL17267375 | 0.68 | CYP2C19 (0.48) | FFAR4CYP2C19HIF1AESR1MAPT | |
| SCHEMBL5788809 | 0.67 | MAPT (0.46) | CYP2C19HIF1ABTN3A1MAPTBACE1 | |
| SCHEMBL11755090 | 0.67 | PTGER2 (0.38) | CYP2C19HIF1AESR1TBXA2R | |
| SCHEMBL7314042 | 0.67 | CACNA1G (0.46) | — | |
| SCHEMBL4855131 | 0.67 | ALDH1A1 (0.48) | FFAR4ESR1HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1041064-A2 | N-substituted alpha aminoacid amides as calcium channel modulators | ELI LILLY AND COMPANY LIMITED (GB) | 2000-10-04 | — | — | EP | disclosed |
| EP-0805147-A1 | Novel N-substituted alpha aminoacid amides as calcium channel modulators | LILLY INDUSTRIES LIMITED (GB) | 1997-11-05 | — | — | EP | disclosed |