Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | F2R | P25116 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.38 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7905215 | 1.00 | TSHR (0.48) | TSHRNFE2L2F2RCA1CA2 | |
| SCHEMBL1932223 | 1.00 | TSHR (0.48) | TSHRNFE2L2F2RCA1CA2 | |
| SCHEMBL9187108 | 0.97 | TSHR (0.46) | TSHRNFE2L2F2RCA1CA2 | |
| SCHEMBL553823 | 0.91 | NR1H3 (0.44) | TSHRNFE2L2CYP1A2LMNA | |
| SCHEMBL21574808 | 0.91 | NR1H3 (0.44) | TSHRNFE2L2CYP1A2LMNA | |
| SCHEMBL29392092 | 0.91 | NR1H3 (0.44) | TSHRNFE2L2CYP1A2LMNA | |
| SCHEMBL553822 | 0.91 | NR1H3 (0.44) | TSHRNFE2L2CYP1A2LMNA | |
| SCHEMBL1674897 | 0.89 | NFE2L2 (0.50) | TSHRNFE2L2ALDH1A1HPGD | |
| Benzene SCHEMBL29196105 | 0.89 | NFE2L2 (0.50) | TSHRNFE2L2ALDH1A1HPGD | |
| SCHEMBL29628296 | 0.89 | NFE2L2 (0.50) | TSHRNFE2L2ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4232014-A1 | ANALOGUES OF PENTAMIDINE AND METHODS FOR TREATING INFECTIONS | Auransa Inc. (US) | 2023-08-30 | — | — | EP | disclosed |
| WO-2022087636-A1 | ANALOGUES OF PENTAMIDINE AND METHODS FOR TREATING INFECTIONS | AURANSA INC. (US) | 2022-04-28 | — | — | WO | disclosed |