Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 3/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22239718 | 0.90 | KMT2A (0.42) | HCRTR2HCRTR1POLBMEN1KMT2A | |
| SCHEMBL17776915 | 0.89 | POLB (0.39) | HCRTR2HCRTR1POLBMEN1KMT2A | |
| SCHEMBL17769905 | 0.88 | ALDH1A1 (0.38) | HCRTR2HCRTR1POLBMEN1KMT2A | |
| SCHEMBL17776916 | 0.88 | OPRK1 (0.39) | POLBRAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL17770481 | 0.88 | OPRK1 (0.39) | POLBRAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22239546 | 0.86 | OPRK1 (0.39) | HCRTR2HCRTR1POLBRAB9ANPC1 | |
| SCHEMBL17769963 | 0.81 | NPC1 (0.36) | POLBRAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22239551 | 0.81 | NPC1 (0.36) | POLBRAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22239639 | 0.79 | MALT1 (0.35) | ALDH1A1TSHR | |
| SCHEMBL17618519 | 0.79 | SCD (0.43) | — |
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-3221317-B1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE IP NO 2 LTD (GB) | 2020-07-22 | — | — | EP | disclosed |