Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC42 | P60953 | 3/20 | 0.40 |
| ▸ | RAC1 | P63000 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.35 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL30128755 | 0.84 | CDC42 (0.43) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL17361251 | 0.79 | CDC42 (0.46) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL7875841 | 0.79 | CDC42 (0.46) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL11201877 | 0.73 | CDC42 (0.41) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL11197597 | 0.69 | CDC42 (0.40) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL9381071 | 0.68 | CA12 (0.36) | KDM4EALDH1A1MAPT | |
| SCHEMBL9383103 | 0.68 | KDM4E (0.40) | KDM4EALDH1A1POLBHTTLMNA | |
| SCHEMBL9381386 | 0.67 | ALDH1A1 (0.39) | CHRM3KDM4EALDH1A1L3MBTL1CARM1 | |
| SCHEMBL10641885 | 0.67 | OPRM1 (0.36) | NPC1OPRM1RAB9AKDM4EALDH1A1 | |
| SCHEMBL11443496 | 0.66 | CHRM2 (0.41) | CHRM3KDM4EALDH1A1L3MBTL1LMNA |
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-5260451-A | Enzyme inhibitors | MERCKLE GMBH (DE) | 1993-11-09 | — | — | US | disclosed |