Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.54 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.54 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | CASP6 | P55212 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | GHSR | Q92847 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22909301 | 0.88 | KMT2A (0.62) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22909306 | 0.88 | CYP3A4 (0.48) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22908672 | 0.82 | PDCD1 (0.58) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL10435326 | 0.82 | MAPT (0.75) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL1661307 | 0.81 | MEN1 (0.46) | KMT2AMAPTMEN1CD274PDCD1 | |
| SCHEMBL22908674 | 0.79 | KMT2A (0.70) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL11895290 | 0.76 | MEN1 (0.54) | KMT2AMAPTMEN1CD274PDCD1 | |
| SCHEMBL11182553 | 0.73 | PDCD1 (0.56) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL10435333 | 0.73 | MAPT (0.67) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL10382658 | 0.72 | MAOB (0.65) | KMT2AMAPTMEN1LMNACD274 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021009384-A1 | NOVEL PYRAZOLONE DERIVATIVES AS PD-1/PD-L1 INTERACTION INHIBITORS | CENTRE HOSPITALIER REGIONAL UNIVERSITAIRE DE LILLE (FR) | 2021-01-21 | — | — | WO | disclosed |