Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28920116 | 0.87 | MEN1 (0.47) | KMT2AMEN1TDP1TSHRPOLB | |
| SCHEMBL6204523 | 0.83 | MEN1 (0.49) | KMT2AMEN1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL21879787 | 0.81 | LMNA (0.54) | ALDH1A1LMNA | |
| SCHEMBL10266928 | 0.81 | ALDH1A1 (0.44) | KMT2AMEN1CYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL13980904 | 0.80 | MEN1 (0.47) | KMT2AMEN1ALDH1A1TDP1POLB | |
| SCHEMBL21879735 | 0.79 | LMNA (0.55) | ALDH1A1LMNA | |
| SCHEMBL11386674 | 0.77 | CYP3A4 (0.47) | CYP4F2CYP4A11ALDH1A1CYP3A4NAMPT | |
| SCHEMBL5699336 | 0.77 | ESR1 (0.44) | ALDH1A1CYP3A4TSHRHSD17B10CYP1A2 | |
| SCHEMBL2384369 | 0.77 | ESR1 (0.44) | ALDH1A1CYP3A4TSHRHSD17B10CYP1A2 | |
| SCHEMBL5699327 | 0.77 | ESR1 (0.44) | ALDH1A1CYP3A4TSHRHSD17B10CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1564200-A1 | Ketone compounds and compositions for cholesterol management and related uses | Esperion Therapeutics Inc. (US) | 2005-08-17 | — | — | EP | disclosed |