Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.59 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NMT2 | O60551 | 1/20 | 0.53 |
| ▸ | NMT1 | P30419 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6044788 | 0.88 | KEAP1 (0.64) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL11344104 | 0.86 | ALDH1A1 (0.68) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL29508063 | 0.85 | ABCB1 (0.67) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL11337833 | 0.85 | ALDH1A1 (0.67) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL3454630 | 0.84 | USP2 (0.67) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL15988103 | 0.81 | ABCB1 (0.68) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL6044278 | 0.81 | MEN1 (0.72) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL29508119 | 0.81 | DRD2 (0.69) | ALDH1A1USP2KEAP1NFE2L2ABCB1 | |
| SCHEMBL4043732 | 0.79 | ALDH1A1 (0.48) | ALDH1A1KEAP1NFE2L2KDM4ETDP1 | |
| SCHEMBL24177747 | 0.79 | ALDH1A1 (0.97) | ALDH1A1KEAP1NFE2L2KDM4ETDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5958929-A | CONGESTIVE HEART FAILURE; HYPOTENSIVE AGENTS | SANOFI (FR) | 1999-09-28 | — | — | US | disclosed |
| US-5736548-A | CYCLIC GUANOSINE 3*,5*-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS; TREATING HEART FAILURE, HYPERTENSION | SANOFI (FR) | 1998-04-07 | — | — | US | disclosed |
| CN-1177963-A | 6-arylpyrazolo [3, 4-d ] pyrimidin-4-ones and compositions and methods of use thereof | SANOFI WINTHROP INC (US) | 1998-04-01 | — | — | CN | disclosed |
| WO-1996028448-A1 | 6-ARYL PYRAZOLO[3,4-d]PYRIMIDIN-4-ONES AND COMPOSITIONS AND METHODS OF USE THEREOF | SANOFI WINTHROP, INC. (US) | 1996-09-19 | — | — | WO | disclosed |