Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 11/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5691362 | 0.89 | HCAR2 (0.39) | HCAR2ALDH1A1MAPTTDP1HSD17B10 | |
| SCHEMBL8519669 | 0.80 | HCAR2 (0.52) | HCAR2ALDH1A1TSHRMAPTTDP1 | |
| SCHEMBL8519666 | 0.80 | HCAR2 (0.52) | HCAR2ALDH1A1TSHRMAPTTDP1 | |
| SCHEMBL28309590 | 0.78 | KEAP1 (0.31) | HCAR2KEAP1NFE2L2 | |
| SCHEMBL27601174 | 0.73 | HCAR2 (0.54) | HCAR2ALDH1A1TSHRMAPTTDP1 | |
| SCHEMBL25388940 | 0.71 | — | — | |
| Fumaric Acid SCHEMBL5691367 | 0.71 | TSHR (0.64) | HCAR2ALDH1A1TSHRMAPTTDP1 | |
| Maleic Acid SCHEMBL5691352 | 0.71 | TSHR (0.64) | HCAR2ALDH1A1TSHRMAPTTDP1 | |
| SCHEMBL28509964 | 0.70 | TSHR (0.38) | ALDH1A1TSHRHSD17B10TP53 | |
| SCHEMBL8519665 | 0.69 | HCAR2 (0.43) | HCAR2TSHRMAPTCYP1A2KEAP1 |
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-5575899-A | ELECTROLYSIS OF A SOLUTION OF ZINC CHLORIDE, NICKEL CHLORIDE AND POTASSIUM CHLORIDE, NONIONIC SURFACTANT WITH NICOTINIC ACID, UREA, THIOUREA, NICOTINAMIDE, THIOGLYCOLIC ACID AND SODIUM THIOSULFATE | KAWASAKI STEEL CORPORATION (JP) | 1996-11-19 | — | — | US | disclosed |