Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | KDM6B | O15054 | 1/20 | 0.36 |
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | KDM5C | P41229 | 1/20 | 0.36 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.36 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | AOC1 | P19801 | 2/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | PDE1A | P54750 | 1/20 | 0.34 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL30504120 | 0.74 | MAPK10 (0.45) | TRPM5KDM4CKDM4EKDM6BKDM4A | |
| SCHEMBL16657366 | 0.73 | ALDH1A1 (0.45) | KDM4EALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL6297758 | 0.71 | CYP2C19 (0.57) | TRPM5CYP2C19KDM1AMAOBTLR7 | |
| SCHEMBL16489564 | 0.71 | KDM4C (0.56) | KDM4CKDM4EKDM6BKDM4AKDM4D | |
| SCHEMBL15722502 | 0.71 | MAOA (0.54) | CYP2C19MAOBKDM4EALDH1A1HSD17B10 | |
| SCHEMBL22346318 | 0.71 | TRPM5 (0.41) | TRPM5CYP2C19KDM1AMAOBTLR7 | |
| SCHEMBL20874597 | 0.71 | TRPM5 (0.41) | TRPM5CYP2C19KDM1AMAOBTLR7 | |
| Hydrochloric Acid SCHEMBL6297635 | 0.70 | CYP2C19 (0.56) | TRPM5CYP2C19KDM1AMAOBTLR7 | |
| SCHEMBL30703857 | 0.70 | AOC1 (0.56) | KDM4EAOC1AOC3ALDH1A1 | |
| SCHEMBL9329604 | 0.70 | AOC1 (0.56) | KDM4EAOC1AOC3ALDH1A1 |
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-0819000-B1 | NODULISPORIC ACID DERIVATIVES | MERCK & CO INC (US) | 2009-07-08 | — | — | EP | disclosed |