Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | KHK | P50053 | 2/20 | 0.40 |
| ▸ | KCNJ6 | P48051 | 3/20 | 0.40 |
| ▸ | KCNJ5 | P48544 | 3/20 | 0.40 |
| ▸ | KCNJ3 | P48549 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320353 | 0.81 | NAMPT (0.60) | NAMPTROCK2ROCK1 | |
| SCHEMBL23320455 | 0.80 | ROCK2 (0.50) | NAMPTMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL23320366 | 0.76 | NAMPT (0.66) | ALDH1A1TSHRHSD17B10NAMPTMTOR | |
| SCHEMBL11615932 | 0.72 | HSD17B10 (0.79) | ALDH1A1TSHRHSD17B10NAMPTMTOR | |
| Formamide SCHEMBL23320449 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TSHRHSD17B10NAMPTMTOR | |
| SCHEMBL23320377 | 0.69 | NAMPT (0.45) | NAMPT | |
| SCHEMBL23320440 | 0.68 | NAMPT (0.63) | NAMPTKHKRAB9AROCK2ROCK1 | |
| SCHEMBL4519247 | 0.68 | HSD17B10 (0.70) | ALDH1A1TSHRHSD17B10NAMPTMTOR | |
| SCHEMBL4531077 | 0.68 | HSD17B10 (0.70) | ALDH1A1TSHRHSD17B10NAMPTMTOR | |
| SCHEMBL14433543 | 0.67 | HSD17B10 (0.72) | ALDH1A1TSHRHSD17B10NAMPTMTOR |
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-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |