Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL30507256 | 0.79 | HSD11B1 (0.45) | HSD11B1CA1CA2DRD2DRD3 | |
| SCHEMBL28905831 | 0.79 | HSD11B1 (0.45) | HSD11B1CA1CA2DRD2DRD3 | |
| SCHEMBL16811754 | 0.75 | HSD11B1 (0.48) | HSD11B1CA1CA2KMT2AMEN1 | |
| SCHEMBL31243801 | 0.75 | HSD11B1 (0.48) | HSD11B1CA1CA2KMT2AMEN1 | |
| SCHEMBL2750188 | 0.72 | CA2 (0.57) | HSD11B1CA1CA2DRD2DRD3 | |
| SCHEMBL13933197 | 0.72 | HSD11B1 (0.46) | HSD11B1CA1CA2KMT2AMEN1 | |
| SCHEMBL15370576 | 0.72 | MEN1 (0.49) | HSD11B1L3MBTL1CA1CA2KMT2A | |
| Hydrogen Sulfide SCHEMBL6248782 | 0.71 | CA2 (0.55) | HSD11B1CA1CA2DRD2DRD3 | |
| SCHEMBL4056753 | 0.71 | CA1 (0.51) | HSD11B1L3MBTL1CA1CA2DRD2 | |
| SCHEMBL19212762 | 0.70 | HSD11B1 (0.38) | HSD11B1CA1CA2NPSR1DRD2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0937045-B1 | N-ARYL SUBSTITUTED TETRAHYDROQUINOLINES LIGANDS FOR RETINOID RECEPTORS HAVING AGONIST, ANTAGONIST OR INVERSE AGONIST TYPE ACTIVITY | ALLERGAN INC (US) | 2004-04-28 | — | — | EP | disclosed |