Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9728847 | 0.70 | KDM4E (0.30) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL37435600 | 0.62 | CYP1A2 (0.36) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL974163 | 0.60 | CYP1A2 (0.36) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL9279571 | 0.59 | KDM4E (0.45) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL2986974 | 0.58 | TRPA1 (0.44) | MAPT | |
| SCHEMBL27618685 | 0.57 | KDM4E (0.33) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL9175820 | 0.56 | NPC1 (0.57) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL11118694 | 0.56 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL22983154 | 0.53 | NOS3 (0.52) | KDM4ENPC1ALDH1A1LMNAGAA | |
| SCHEMBL2503986 | 0.53 | — | — |
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-6436922-B1 | TREATING IRRITABLE BOWEL SYNDROME | AJINOMOTO CO., INC. (JP) | 2002-08-20 | — | — | US | disclosed |