Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.45 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.45 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | LPL | P06858 | 1/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3732191 | 0.91 | LTA4H (0.51) | PARP1HRH3PARP2KCNH2CHRM2 | |
| SCHEMBL3721056 | 0.91 | LTA4H (0.51) | PARP1HRH3PARP2KCNH2CHRM2 | |
| SCHEMBL3663608 | 0.91 | LTA4H (0.51) | PARP1HRH3PARP2KCNH2CHRM2 | |
| SCHEMBL29957623 | 0.83 | PARP1 (0.45) | PARP1TNKSSIGMAR1DRD2HTR2A | |
| SCHEMBL18580991 | 0.83 | HRH3 (0.67) | PARP1HRH3ACHEALDH1A1LPL | |
| SCHEMBL12074554 | 0.81 | ALDH1A1 (0.56) | PARP1HRH3TNKSKCNH2ACHE | |
| SCHEMBL15096667 | 0.80 | HRH3 (0.46) | HRH3ACHEALDH1A1LPLLIPG | |
| SCHEMBL4591986 | 0.80 | KDM4E (0.57) | PARP1HRH3TNKSSIGMAR1CHRM2 | |
| SCHEMBL4260843 | 0.80 | LMNA (0.57) | PARP1HRH3PARP2TNKSSIGMAR1 | |
| SCHEMBL15033014 | 0.80 | LTA4H (0.46) | HRH3SIGMAR1ACHEKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |