Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LSS | P48449 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL20192298 | 0.83 | KDM4E (0.46) | LSSKDM4EALDH1A1PRKAA2 | |
| SCHEMBL2477262 | 0.80 | RORC (0.53) | LSSSIGMAR1MEN1KMT2APRKAA2 | |
| SCHEMBL20192521 | 0.79 | ALDH1A1 (0.43) | LSSKDM4EALDH1A1MEN1LMNA | |
| SCHEMBL20192524 | 0.78 | F10 (0.44) | LSSKDM4EALDH1A1MEN1LMNA | |
| SCHEMBL20192575 | 0.77 | ALDH1A1 (0.53) | TSHRKDM4EALDH1A1GAAMAPT | |
| SCHEMBL4246868 | 0.76 | EPHX2 (0.54) | TSHRALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL20750406 | 0.76 | PKM (0.50) | SIGMAR1 | |
| SCHEMBL20192497 | 0.76 | ALDH1A1 (0.46) | LSSSIGMAR1KDM4EALDH1A1MAPT | |
| SCHEMBL1018788 | 0.76 | MEN1 (0.46) | LSSSIGMAR1TSHRKDM4EALDH1A1 | |
| SCHEMBL12698702 | 0.75 | HSD11B1 (0.45) | ALDH1A1MEN1LMNAKMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012151452-A1 | PYRUVATE KINASE ACTIVATORS FOR USE IN THERAPY | AGIOS PHARMACEUTICALS, INC (US) | 2012-11-08 | — | — | WO | disclosed |
| WO-2012092442-A1 | THERAPEUTIC COMPOUNDS AND COMPOSITIONS | AGIOS PHARMACEUTICALS, INC. (US) | 2012-07-05 | — | — | WO | disclosed |