Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6451314 | 0.90 | HTR3A (0.38) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| SCHEMBL6451317 | 0.90 | HTR3A (0.38) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| SCHEMBL15611580 | 0.89 | HTR3A (0.43) | HTR3ASRD5A1MAP1LC3BSLC18A3HSD17B10 | |
| SCHEMBL8972206 | 0.89 | HTR3A (0.44) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| SCHEMBL5271028 | 0.89 | HTR3A (0.44) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| Hydrochloric Acid SCHEMBL28701325 | 0.87 | HTR3A (0.43) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| SCHEMBL9182846 | 0.84 | SLC2A1 (0.41) | HTR3ASRD5A1SLC2A1MAP1LC3BSLC18A3 | |
| SCHEMBL14140574 | 0.81 | LMNA (0.40) | MAP1LC3BSLC18A3MAPTCYP1A2CYP2C9 | |
| SCHEMBL9517895 | 0.81 | KDM1A (0.38) | MAP1LC3BSLC18A3SLC6A2SLC6A3 | |
| SCHEMBL8036501 | 0.81 | AKR1C3 (0.52) | SLC18A3MAPTLMNA |
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-0253501-A2 | N-disubstituted cycloalkylmethyl amines useful as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-20 | — | — | EP | disclosed |