Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | DNM1 | Q05193 | 7/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | MLNR | O43193 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9482851 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL1478181 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL9485642 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL3704021 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL5693523 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL9480136 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL9481026 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| SCHEMBL1476262 | 1.00 | TSHR (0.61) | TSHRHPGDALDH1A1CYP3A4HTT | |
| Hydrochloric Acid SCHEMBL7619758 | 0.98 | TSHR (0.59) | TSHRHPGDALDH1A1CYP3A4HTT | |
| Bromide SCHEMBL8196037 | 0.98 | TSHR (0.59) | TSHRHPGDALDH1A1CYP3A4HTT |
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-2023287067-A1 | ANTIBACTERIAL COMPOUND | 주식회사 엘지화학 | 2023-01-19 | — | — | WO | disclosed |
| US-5270046-A | Heparin bound anti-thrombotic material | UBE INDUSTRIES, LTD. (JP) | 1993-12-14 | — | — | US | disclosed |