Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NQO1 | P15559 | 1/20 | 0.38 |
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MPI | P34949 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL9196600 | 0.92 | HTR2B (0.46) | HTR2BPGAM1HTR2CKDM4EMAPT | |
| SCHEMBL9198756 | 0.86 | HTR2B (0.43) | HTR2BPGAM1HTR2CKDM4EMAPT | |
| SCHEMBL9039708 | 0.81 | KDM4E (0.40) | HTR2BKDM4EALDH1A1CNR1CNR2 | |
| SCHEMBL9193883 | 0.80 | ELANE (0.43) | HTR2BPGAM1KDM4EMAPTALDH1A1 | |
| SCHEMBL9196603 | 0.80 | HTR2B (0.44) | HTR2BPGAM1HTR2CKDM4EMAPT | |
| SCHEMBL9199797 | 0.79 | CNR1 (0.36) | HTR2BPGAM1HTR2CCNR1CNR2 | |
| SCHEMBL6175677 | 0.79 | PGAM1 (0.47) | HTR2BPGAM1HTR2CKDM4EMAPT | |
| SCHEMBL6174221 | 0.77 | HTR2B (0.49) | HTR2BPGAM1HTR2CKDM4EMAPT | |
| SCHEMBL6175609 | 0.77 | CYP2C9 (0.54) | KDM4EALDH1A1NQO1 | |
| SCHEMBL6173602 | 0.77 | CYP2C9 (0.54) | KDM4EALDH1A1NQO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0668860-A1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | PHARMACIA & UPJOHN COMPANY (US) | 1995-08-30 | — | — | EP | disclosed |