Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 8/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 6/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KDM4D | Q6B0I6 | 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 | |
|---|---|---|---|---|
| SCHEMBL6028072 | 0.81 | CTSS (0.46) | KCNA5CNR1CTSSCTSKGPR139 | |
| SCHEMBL320306 | 0.81 | GPR139 (0.45) | KCNA5CNR1CTSSCTSKGPR139 | |
| SCHEMBL3937793 | 0.80 | FFAR1 (0.56) | KCNA5FFAR1TNFCNR1ADAMTS4 | |
| SCHEMBL28778783 | 0.80 | KCNA5 (0.42) | KCNA5CTSSCTSKMMP13 | |
| SCHEMBL29728624 | 0.80 | KCNA5 (0.42) | KCNA5CTSSCTSKMMP13 | |
| SCHEMBL7352439 | 0.78 | SLC7A5 (0.49) | — | |
| SCHEMBL28319376 | 0.78 | PDK1 (0.41) | KCNA5TNFCNR1CNR2KDM4D | |
| SCHEMBL13326255 | 0.78 | S1PR3 (0.39) | CTSSCTSK | |
| SCHEMBL28057840 | 0.78 | KCNA5 (0.40) | KCNA5TNFCNR1ADAMTS4MMP13 | |
| SCHEMBL2296620 | 0.77 | GRM4 (0.43) | TNFCTSSCTSKCNR2KDM4D |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0682663-B1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | UPJOHN CO (US) | 2001-04-18 | — | — | EP | disclosed |
| US-5686486-A | 4-hydroxy-benzopyran-2-ones and 4-hydroxy-cycloalkyl b!pyran-2-ones useful to treat retroviral infections | PHARMACIA & UPJOHN COMPANY (US) | 1997-11-11 | — | — | US | disclosed |
| WO-1994018188-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL[B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | THE UPJOHN COMPANY (US) | 1994-08-18 | — | — | WO | disclosed |