Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9860834 | 0.85 | GFER (0.42) | ALDH1A1TAAR1GFERESR1ESR2 | |
| SCHEMBL5358862 | 0.78 | ALDH1A1 (0.37) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL4044380 | 0.78 | CYP3A4 (0.42) | CYP2D6PMP22 | |
| SCHEMBL9553020 | 0.77 | MAOB (0.46) | TAAR1GFERESR1ESR2FFAR1 | |
| SCHEMBL9192375 | 0.77 | CA2 (0.42) | ALDH1A1TAAR1GFERESR1ESR2 | |
| SCHEMBL9552844 | 0.77 | MAOB (0.46) | TAAR1GFERESR1ESR2FFAR1 | |
| SCHEMBL8835604 | 0.77 | CA1 (0.48) | TSHRCA1CA2 | |
| SCHEMBL130660 | 0.74 | TAAR1 (0.59) | ALOX15TAAR1LMNA | |
| SCHEMBL2842637 | 0.74 | ALDH1A1 (0.34) | ALDH1A1TAAR1GFERESR1ESR2 | |
| SCHEMBL1441024 | 0.72 | CA2 (0.52) | ALDH1A1HPGDHSD17B10THRBGAA |
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-5633268-A | FUNGICIDES, INSECTICIDES, PESTICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1997-05-27 | — | — | US | disclosed |