Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 4/20 | 0.41 |
| ▸ | DRD5 | P21918 | 4/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22953344 | 0.80 | PARP1 (0.39) | PARP1DRD1DRD5CHRNB2CHRNA4 | |
| SCHEMBL22952989 | 0.80 | PARP1 (0.43) | PARP1LMNAKDM4EALDH1A1CYP3A4 | |
| SCHEMBL22953386 | 0.76 | PARP1 (0.39) | PARP1LMNAHTR2AKIF11 | |
| SCHEMBL22952986 | 0.76 | PARP1 (0.46) | PARP1DRD1LMNAKDM4EALDH1A1 | |
| SCHEMBL22953389 | 0.74 | HTR2A (0.34) | PARP1DRD1DRD5HTR2A | |
| SCHEMBL16938669 | 0.71 | HTR2A (0.60) | PARP1DRD1DRD5CYP3A4HTR2A | |
| SCHEMBL29383346 | 0.71 | HTR2A (0.60) | PARP1DRD1DRD5CYP3A4HTR2A | |
| SCHEMBL3670524 | 0.71 | HTR2A (0.60) | PARP1DRD1DRD5CYP3A4HTR2A | |
| SCHEMBL3672464 | 0.71 | HTR2A (0.60) | PARP1DRD1DRD5CYP3A4HTR2A | |
| SCHEMBL22953390 | 0.70 | HTR2A (0.36) | PARP1DRD1HTR2AKIF11 |
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-2021021922-A1 | COMPOUNDS AND METHODS FOR TREATING FIBROTIC PATHOLOGIES | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2021-02-04 | — | — | WO | disclosed |