Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.43 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 6/20 | 0.35 |
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CA9 | Q16790 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LPAR3 | Q9UBY5 | 5/20 | 0.34 |
| ▸ | LPAR2 | Q9HBW0 | 4/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3806973 | 0.98 | SPHK2 (0.46) | SPHK2SPHK1EPHX1CA1CA2 | |
| SCHEMBL10863315 | 0.98 | SPHK2 (0.46) | SPHK2SPHK1EPHX1CA1CA2 | |
| SCHEMBL10863262 | 0.93 | — | — | |
| SCHEMBL6155343 | 0.83 | — | — | |
| SCHEMBL27929676 | 0.82 | SPHK2 (0.41) | SPHK2SPHK1EPHX1CA1CA2 | |
| Hydrochloric Acid SCHEMBL11080400 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL27509464 | 0.81 | NOS3 (0.32) | SPHK2SPHK1NOS3NOS1NOS2 | |
| SCHEMBL10528917 | 0.79 | SPHK2 (0.34) | SPHK2SPHK1EPHX1MAPT | |
| Propanol SCHEMBL27533077 | 0.77 | CNR2 (0.31) | NOS3NOS1NOS2 | |
| SCHEMBL1756788 | 0.77 | EPHX1 (0.45) | EPHX1CA1CA2CA9MEN1 |
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-0173322-B1 | 1-(2-OXYAMINOSULFONYLPHENYL-SULFONYL)-3-HETEROARYL UREAS | BAYER AG (DE) | 1988-12-28 | — | — | EP | disclosed |
| EP-0173317-A1 | Unsymmetrical sulfonyl guanidines | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |
| EP-0173315-A1 | Oxyguanidine derivatives | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |