Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL27958749 | 0.89 | ALDH1A1 (0.56) | ALDH1A1LMNAHSD17B10TSHRGAA | |
| Hydrogen Sulfide SCHEMBL27958752 | 0.89 | — | — | |
| SCHEMBL3674 | 0.86 | — | — | |
| SCHEMBL29697593 | 0.86 | ALDH1A1 (0.59) | ALDH1A1LMNAHSD17B10TSHRGAA | |
| Hydrazine SCHEMBL27723026 | 0.83 | — | — | |
| Tetramethylammonium Ion SCHEMBL28054176 | 0.83 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10TSHRGAA | |
| Bicarbonate SCHEMBL895901 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNAHSD17B10TSHRGAA | |
| SCHEMBL16444754 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL904397 | 0.83 | — | — | |
| Water SCHEMBL21436717 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNAHSD17B10TSHRGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5534649-A | REACTING UREA, METHYL CARBAMATE, ETHYL CARBAMATE WITH METHANOL, ETHANOL USING QUARTERNARY AMMONIUM CATALYST | TAMA CHEMICALS CO., LTD. (JP) | 1996-07-09 | — | — | US | claimed |
| US-5534649-A | REACTING UREA, METHYL CARBAMATE, ETHYL CARBAMATE WITH METHANOL, ETHANOL USING QUARTERNARY AMMONIUM CATALYST | TAMA CHEMICALS CO., LTD. (JP) | 1996-07-09 | — | — | US | disclosed |