Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7957021 | 0.86 | KDM4E (0.58) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL7962009 | 0.85 | KDM4E (0.60) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL7964562 | 0.78 | NPC1 (0.51) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5734066 | 0.77 | MAPT (0.55) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5733357 | 0.77 | KDM4E (0.63) | KDM4EMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL13467867 | 0.76 | CYP2D6 (0.79) | KDM4EMEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL7947674 | 0.74 | SMN1; SMN2 (0.53) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL7962019 | 0.74 | NPC1 (0.56) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL14175879 | 0.73 | TDP1 (0.53) | KDM4EMEN1KMT2ACYP2D6CYP2C19 | |
| SCHEMBL7947543 | 0.72 | PTPN1 (0.55) | KDM4EMEN1KMT2AALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |