Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | LIPE | Q05469 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22415454 | 0.77 | ESR2 (0.40) | ALDH1A1MAPTLMNACYP2C9ESR2 | |
| SCHEMBL19956767 | 0.76 | DGAT1 (0.48) | ALDH1A1MAPTLMNACYP2C9ESR2 | |
| SCHEMBL19956739 | 0.76 | DGAT1 (0.48) | ALDH1A1MAPTLMNACYP2C9ESR2 | |
| SCHEMBL19956786 | 0.72 | SPHK1 (0.40) | ALDH1A1MAPTLMNACYP2C9 | |
| SCHEMBL19956766 | 0.71 | ALDH1A1 (0.39) | ALDH1A1MAPTLMNACYP2C9ESR2 | |
| SCHEMBL1405569 | 0.69 | ESR2 (0.50) | ALDH1A1MAPTLMNAPOLBCYP2C9 | |
| SCHEMBL10607267 | 0.68 | ESR2 (0.46) | ALDH1A1MAPTLMNACYP2C9ESR2 | |
| SCHEMBL11284288 | 0.67 | ESR2 (0.39) | CYP2C9ESR2ESR1CYP3A4DGAT1 | |
| SCHEMBL15698271 | 0.67 | HPGD (0.45) | ALDH1A1MAPTLMNAESR2CCR1 | |
| SCHEMBL14959893 | 0.67 | ESR2 (0.44) | ALDH1A1MAPTLMNACYP2C9ESR2 |
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-2805951-B1 | Inhibitors of diacylglycerol o-acyltransferase 1 (DGAT-1) and uses thereof | METABASIS THERAPEUTICS INC (US) | 2018-03-14 | — | — | EP | disclosed |