Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.41 |
| ▸ | LPL | P06858 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14934909 | 0.81 | KEAP1 (0.55) | DGAT1KEAP1NFE2L2LIPGLPL | |
| SCHEMBL16030765 | 0.81 | KEAP1 (0.55) | DGAT1KEAP1NFE2L2LIPGLPL | |
| SCHEMBL15113138 | 0.80 | ATM (0.45) | DGAT1KEAP1NFE2L2LIPGLPL | |
| SCHEMBL19388247 | 0.80 | ATM (0.45) | DGAT1KEAP1NFE2L2LIPGLPL | |
| SCHEMBL16785551 | 0.77 | HDAC1 (0.45) | FFAR1TNKSTNKS2HDAC1HDAC6 | |
| SCHEMBL20054171 | 0.76 | ATM (0.47) | RXRARXRBRXRGCCNE2CCNE1 | |
| SCHEMBL29707329 | 0.75 | CA2 (0.52) | KEAP1NFE2L2LIPGLPLHDAC3 | |
| SCHEMBL29707332 | 0.75 | CA2 (0.52) | KEAP1NFE2L2LIPGLPLHDAC3 | |
| SCHEMBL16775744 | 0.75 | ATM (0.43) | FFAR1EPHX1 | |
| SCHEMBL30176163 | 0.75 | L3MBTL1 (0.65) | DGAT1KEAP1NFE2L2 |
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-3019196-B1 | COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-06-06 | — | — | EP | disclosed |
| EP-2802326-B1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-04-18 | — | — | EP | disclosed |