Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 2/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21646466 | 0.81 | PRKCI (0.41) | PRKCITBXAS1NAMPTNTRK1NR3C1 | |
| SCHEMBL25124500 | 0.77 | TBXAS1 (0.40) | PRKCITBXAS1NAMPTNTRK1NR3C1 | |
| SCHEMBL23432572 | 0.76 | TBXAS1 (0.37) | TBXAS1NAMPTTDP1NR3C1AXL | |
| SCHEMBL17561679 | 0.74 | TBXAS1 (0.40) | PRKCITBXAS1NAMPTNTRK1NR3C1 | |
| SCHEMBL23055240 | 0.70 | TDP1 (0.34) | TDP1AXLALDH1A1LMNACYP3A4 | |
| SCHEMBL21037102 | 0.70 | TBXAS1 (0.50) | PRKCITBXAS1NAMPTNTRK1TDP1 | |
| SCHEMBL23055261 | 0.70 | MAPK1 (0.36) | TDP1ALDH1A1LMNACYP3A4THRB | |
| SCHEMBL24629446 | 0.69 | TBXAS1 (0.43) | PRKCITBXAS1NAMPTNTRK1NR3C1 | |
| SCHEMBL23055242 | 0.68 | PIK3CD (0.38) | NAMPTNTRK1TDP1ALDH1A1LMNA | |
| SCHEMBL23055259 | 0.68 | IRAK4 (0.43) | NAMPTNTRK1TDP1ALDH1A1LMNA |
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-2021149767-A1 | HETEROCYCLIC DERIVATIVE | 大日本住友製薬株式会社 | 2021-07-29 | — | — | WO | disclosed |
| WO-2021039961-A1 | RING-FUSED PYRAZOLE DERIVATIVE | 大日本住友製薬株式会社 | 2021-03-04 | — | — | WO | disclosed |