Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.70 |
| ▸ | MAPT | P10636 | 5/20 | 0.70 |
| ▸ | MEN1 | O00255 | 3/20 | 0.70 |
| ▸ | LMNA | P02545 | 3/20 | 0.70 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.56 |
| ▸ | PDCD1 | Q15116 | 4/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RPA1 | P27694 | 1/20 | 0.40 |
| ▸ | TSPO | P30536 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10435326 | 0.92 | MAPT (0.75) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22908646 | 0.88 | KMT2A (0.61) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22908712 | 0.87 | KMT2A (0.60) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22909309 | 0.86 | KMT2A (0.55) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22908683 | 0.84 | KMT2A (0.58) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22909489 | 0.84 | CD274 (0.57) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL11182553 | 0.82 | PDCD1 (0.56) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL22909301 | 0.82 | KMT2A (0.62) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL9770297 | 0.80 | MAPT (0.60) | KMT2AMAPTMEN1LMNACD274 | |
| SCHEMBL10435333 | 0.79 | MAPT (0.67) | 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 2 patents. 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 |
| EP-3766544-A1 | NOVEL PYRAZOLONE DERIVATIVES AS PD-1/PD-L1 INTERACTION INHIBITORS | Centre Hospitalier Regional Universitaire de Lille (FR) | 2021-01-20 | — | — | EP | disclosed |