Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10692592 | 0.88 | BACE1 (0.44) | BACE1BACE2ARALDH1A1MEN1 | |
| SCHEMBL10692622 | 0.86 | CNR1 (0.39) | BACE1ARHTTLMNANR3C1 | |
| SCHEMBL10695992 | 0.81 | SCN9A (0.39) | ARALDH1A1MAPTLMNASCN9A | |
| SCHEMBL10695891 | 0.78 | OPRD1 (0.41) | ARNR3C1 | |
| SCHEMBL10692682 | 0.76 | NPC1 (0.47) | BACE1ARALDH1A1USP2MAPT | |
| SCHEMBL10691593 | 0.75 | L3MBTL1 (0.42) | BACE1BACE2ALDH1A1MEN1MAPT | |
| SCHEMBL10694576 | 0.73 | POLB (0.33) | BACE1ALDH1A1MAPTHSD17B10HTT | |
| SCHEMBL10690604 | 0.70 | TDP1 (0.42) | ALDH1A1MAPTLMNASCN9AL3MBTL1 | |
| SCHEMBL20714380 | 0.69 | L3MBTL1 (0.41) | BACE1ALDH1A1MAPTHTTLMNA | |
| SCHEMBL31294850 | 0.69 | ADAMTS5 (0.46) | BACE1BACE2ALDH1A1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4778793-A | CONTROLLING CALCIUM CONCENTRATION-CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-10-18 | — | — | US | disclosed |