Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | LYN | P07948 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13797973 | 0.79 | LYN (0.58) | KMT2AMEN1POLBCYP1A2CYP3A4 | |
| SCHEMBL13359289 | 0.72 | LYN (0.60) | KMT2AMEN1POLBCYP1A2CYP3A4 | |
| SCHEMBL13797974 | 0.69 | LYN (0.74) | KMT2AMEN1POLBCYP1A2CYP3A4 | |
| SCHEMBL13359237 | 0.69 | LYN (0.55) | KMT2AMEN1POLBCYP1A2CYP3A4 | |
| SCHEMBL13797963 | 0.66 | LYN (0.79) | LYNMAPK9MAPK14 | |
| SCHEMBL14288429 | 0.63 | CYP1A2 (0.63) | KMT2AMEN1POLBCYP1A2CYP3A4 | |
| SCHEMBL2128183 | 0.62 | HCAR3 (1.00) | HCAR3ALDH1A1KDM4E | |
| SCHEMBL4249317 | 0.62 | HCAR3 (0.59) | KMT2AMEN1POLBHCAR3ALDH1A1 | |
| SCHEMBL1542559 | 0.62 | HCAR3 (0.43) | CYP3A4HCAR3LYNMAPK9ALDH1A1 | |
| SCHEMBL24218510 | 0.61 | HCAR3 (0.76) | HCAR3ALDH1A1HDAC1KDM4E |
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-1497278-B1 | HETEROCYCLIC AMIDE DERIVATIVES AS CYTOKINE INHIBITORS | BOEHRINGER INGELHEIM PHARMA (US) | 2010-05-26 | — | — | EP | disclosed |