Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | HSD17B3 | P37058 | 5/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | PLA2G5 | P39877 | 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 | |
|---|---|---|---|---|
| Octane SCHEMBL29136412 | 1.00 | ALDH1A1 (0.50) | ALDH1A1TSHRPLA2G2ATHRATHRB | |
| Heptane SCHEMBL28388769 | 1.00 | ALDH1A1 (0.50) | ALDH1A1TSHRPLA2G2ATHRATHRB | |
| Hexane SCHEMBL15578091 | 0.98 | ALDH1A1 (0.46) | ALDH1A1TSHRPLA2G2ATHRATHRB | |
| Hexane SCHEMBL29096153 | 0.93 | CES2 (0.46) | ALDH1A1TSHRPLA2G2ACES2CES1 | |
| SCHEMBL28385267 | 0.89 | TSHR (0.48) | ALDH1A1TSHRPLA2G2ATHRATHRB | |
| Octane SCHEMBL29136411 | 0.86 | HSD17B3 (0.52) | ALDH1A1TSHRTHRATHRBHSD17B3 | |
| Heptane SCHEMBL28421239 | 0.86 | HSD17B3 (0.52) | ALDH1A1TSHRTHRATHRBHSD17B3 | |
| SCHEMBL5948532 | 0.85 | PLA2G2A (0.68) | TSHRPLA2G2ATHRATHRBTP53 | |
| SCHEMBL4592928 | 0.85 | PLA2G2A (0.68) | TSHRPLA2G2ATHRATHRBTP53 | |
| SCHEMBL5949309 | 0.85 | PLA2G2A (0.68) | TSHRPLA2G2ATHRATHRBTP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112275140-B | Polyamide nanofiltration membrane with patterned surface and preparation method thereof | 天津工业大学 | 2022-02-18 | — | — | CN | disclosed |
| CN-112275140-A | Polyamide nanofiltration membrane with patterned surface and preparation method thereof | 天津工业大学 | 2021-01-29 | — | — | CN | disclosed |