Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11819421 | 0.91 | HTR2A (0.53) | KDM4EALDH1A1USP2HTR2AMAPT | |
| SCHEMBL6815422 | 0.88 | HTR2C (0.61) | HTR2AHTR2C | |
| SCHEMBL7029357 | 0.87 | QDPR (0.52) | KDM4EALDH1A1USP2HTR2AMAPT | |
| SCHEMBL2570589 | 0.85 | MAPT (0.48) | KDM4EALDH1A1USP2HTR2AMAPT | |
| SCHEMBL6924205 | 0.84 | ABCB1 (0.43) | KDM4EALDH1A1MAPTLMNAADRA1A | |
| SCHEMBL6717514 | 0.83 | EHMT2 (0.42) | KDM4EALDH1A1HTR2AMAPTLMNA | |
| SCHEMBL6714974 | 0.82 | ABCB1 (0.47) | KDM4EALDH1A1HTR2AMAPTLMNA | |
| SCHEMBL8536319 | 0.81 | SLC6A2 (0.44) | KDM4EALDH1A1MAPTLMNANR4A1 | |
| SCHEMBL7880812 | 0.81 | HTR2A (0.47) | HTR2AHTR2C | |
| SCHEMBL4771915 | 0.81 | MEN1 (0.52) | ALDH1A1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010051236-A1 | ISONICOTINAMIDE OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2010-05-06 | — | — | WO | disclosed |