Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | NQO1 | P15559 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3465063 | 0.80 | MEN1 (0.69) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL2631459 | 0.80 | MEN1 (0.51) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL1435344 | 0.79 | MEN1 (0.58) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL7074497 | 0.76 | MEN1 (0.62) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL16560481 | 0.74 | ALDH1A1 (0.66) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| 3,4-Methylendioxy Acetophenone SCHEMBL29405437 | 0.73 | KDM4E (0.71) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL13985921 | 0.73 | ALDH1A1 (0.58) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| 3,4-Methylendioxy Acetophenone SCHEMBL137979 | 0.73 | KDM4E (0.71) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL21451034 | 0.73 | MEN1 (0.59) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL16152423 | 0.72 | KMT2A (0.58) | MEN1KMT2AALDH1A1SMN1; SMN2MAPK1 |
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-2750677-B1 | KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | CHDI FOUNDATION INC (US) | 2017-03-22 | — | — | EP | disclosed |