Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ME2 | P23368 | 1/20 | 0.39 |
| ▸ | ME1 | P48163 | 1/20 | 0.39 |
| ▸ | ME3 | Q16798 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11378900 | 0.86 | BTK (0.47) | BTKADORA1ALDH1A1ADORA3HPGD | |
| SCHEMBL11156635 | 0.83 | CNR2 (0.52) | BTKPOLBCNR2NPSR1 | |
| SCHEMBL22130462 | 0.77 | RAB9A (0.49) | BTKALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL11161490 | 0.76 | BTK (0.44) | BTKADORA1ALDH1A1ADORA3GAA | |
| SCHEMBL10051966 | 0.76 | CHEK1 (0.51) | ADORA1ALDH1A1ADORA3GAAHPGD | |
| SCHEMBL9823477 | 0.75 | TDP1 (0.64) | ALDH1A1GAAHPGDSMN1; SMN2MEN1 | |
| SCHEMBL2885212 | 0.75 | ALDH1A1 (0.57) | ALDH1A1GAAKMT2APOLB | |
| SCHEMBL11152852 | 0.75 | BTK (0.46) | BTKADORA1ALDH1A1ADORA3HPGD | |
| SCHEMBL11153562 | 0.75 | BTK (0.44) | BTKADORA1ALDH1A1ADORA3GAA | |
| SCHEMBL11153575 | 0.75 | BTK (0.44) | BTKADORA1ALDH1A1ADORA3GAA |
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 |
|---|---|---|---|---|---|---|---|
| JP-56007782-A | — | — | None | — | — | JP | disclosed |
| JP-S567782-A | NOVEL PYRIDINECARBOXAMIDE DERIVATIVE AND ITS PREPARATION | TANABE SEIYAKU CO LTD | 1981-01-27 | — | — | JP | disclosed |