Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | OTC | P00480 | 1/20 | 0.33 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CASP2 | P42575 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17482389 | 0.81 | TSHR (0.38) | ALDH1A1ADRA1AEPHX1FAAHTSHR | |
| SCHEMBL7098645 | 0.80 | MEN1 (0.41) | KMT2AMEN1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL14094259 | 0.79 | KDM4E (0.54) | ALDH1A1KDM4EMAPK1HIF1AADRA1A | |
| SCHEMBL8536470 | 0.77 | MCL1 (0.53) | KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL14682812 | 0.77 | KMT2A (0.45) | KMT2AMEN1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL12927409 | 0.76 | TSHR (0.40) | ALDH1A1FAAHTSHRHPGDGAA | |
| SCHEMBL10682467 | 0.75 | KDM4E (0.59) | KMT2AMEN1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL27253415 | 0.75 | KDM4E (0.59) | KMT2AMEN1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL20836565 | 0.75 | CYP2D6 (0.52) | KMT2AMEN1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL19131288 | 0.75 | GABBR2 (0.39) | ALDH1A1TSHRHPGDGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-20030009005-A1 | Acetoacetylated diamines and polyamines | LONZA AG (CH) | 2003-01-09 | — | — | US | claimed |
| US-20030009005-A1 | Acetoacetylated diamines and polyamines | LONZA AG (CH) | 2003-01-09 | — | — | US | disclosed |