Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 1/20 | 0.45 |
| ▸ | OXTR | P30559 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29700011 | 0.98 | — | — | |
| SCHEMBL60305 | 0.98 | — | — | |
| SCHEMBL4579661 | 0.95 | RYR2 (0.45) | RYR2OXTRPNMTCD44MAOB | |
| Water SCHEMBL28227861 | 0.95 | RYR2 (0.45) | RYR2OXTRPNMTCD44MAOB | |
| SCHEMBL28993067 | 0.95 | RYR2 (0.45) | RYR2OXTRPNMTCD44MAOB | |
| Methyl Alcohol SCHEMBL5345590 | 0.91 | RYR2 (0.42) | RYR2OXTRPNMTCD44MAOB | |
| Pyridine SCHEMBL28928515 | 0.84 | RYR2 (0.38) | RYR2ALOX15HSD17B10TDP1TSHR | |
| SCHEMBL18638474 | 0.80 | CA12 (0.41) | RYR2OXTRPNMTCD44MAOB | |
| SCHEMBL220767 | 0.74 | HTR2C (0.46) | RYR2PNMTCD44MAOBHTR2C | |
| SCHEMBL7164803 | 0.74 | RYR2 (0.44) | RYR2OXTRPNMTCD44MAOB |
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-1136591-A1 | HYDROPHILIZING AGENT FOR METALLIC MATERIAL, HYDROPHILIZING FLUID, METHOD OF HYDROPHILIZING, METALLIC MATERIAL, AND HEAT EXCHANGER | NIHON PARKERIZING CO., LTD. (JP) | 2001-09-26 | — | — | EP | disclosed |