Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 10/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9867025 | 1.00 | HCAR2 (0.47) | HCAR2HCAR3CYP1A2MAOBMAPT | |
| SCHEMBL9867760 | 0.86 | HCAR2 (0.52) | HCAR2HCAR3CYP1A2MAOBMAPT | |
| SCHEMBL9867753 | 0.86 | HCAR2 (0.52) | HCAR2HCAR3CYP1A2MAOBMAPT | |
| SCHEMBL9867885 | 0.81 | HCAR2 (0.47) | HCAR2HCAR3CYP1A2MAOBNPC1 | |
| SCHEMBL9867879 | 0.81 | HCAR2 (0.47) | HCAR2HCAR3CYP1A2MAOBNPC1 | |
| SCHEMBL9866117 | 0.81 | HCAR2 (0.47) | HCAR2HCAR3CYP1A2MAOBMAPT | |
| SCHEMBL9866112 | 0.81 | HCAR2 (0.47) | HCAR2HCAR3CYP1A2MAOBMAPT | |
| SCHEMBL9868402 | 0.80 | MAPT (0.40) | CYP1A2MAOBMAPTNPC1RAB9A | |
| SCHEMBL9868397 | 0.80 | MAPT (0.40) | CYP1A2MAOBMAPTNPC1RAB9A | |
| SCHEMBL6756867 | 0.79 | HCAR2 (0.46) | HCAR2HCAR3CYP1A2MAOBMAPT |
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-5017601-A | Anti-ulcer 5-(2-substituted ethenyl)-3(2H)-furanones | AMERICAN HOME PRODUCTS CORPORATION (US) | 1991-05-21 | — | — | US | disclosed |
| US-5010102-A | Anti-ulcer 5-(2-substituted ethenyl)-3(2H)-furanones | AMERICAN HOME PRODUCTS CORP. (US) | 1991-04-23 | — | — | US | disclosed |
| US-5001126-A | Anti-ulcer 5-(2-substituted ethenyl)-3(2H)-furanones | AMERICAN HOME PRODUCTS CORPORATION (US) | 1991-03-19 | — | — | US | disclosed |
| US-4966905-A | Anti-ulcer 5-(2-substituted ethenyl)-3-(2H)-furanones | AMERICAN HOME PRODUCTS CORPORATION (US) | 1990-10-30 | — | — | US | disclosed |