Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.38 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11357992 | 0.86 | GABRA1 (0.38) | CA2ALDH1A1TSHRTDP1ALOX15 | |
| SCHEMBL136457 | 0.84 | CA2 (0.32) | CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL31289647 | 0.84 | CA2 (0.32) | CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL5910979 | 0.84 | CA2 (0.32) | CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL6061735 | 0.84 | CA2 (0.32) | CA2ALDH1A1TSHRTDP1MAPT | |
| SCHEMBL142313 | 0.84 | ALDH1A1 (0.48) | CA2ALDH1A1TSHRTDP1ALOX15 | |
| SCHEMBL1322769 | 0.84 | CA2 (0.32) | CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL11747935 | 0.82 | CA2 (0.31) | CA2ALDH1A1TSHRTDP1 | |
| Ammonia Solution, Strong SCHEMBL478297 | 0.82 | ALDH1A1 (0.46) | CA2ALDH1A1TSHRTDP1ALOX15 | |
| SCHEMBL304569 | 0.80 | CA2 (0.57) | CA2ALDH1A1TSHRTDP1ALOX15 |
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-6503662-B1 | Tert-butylbenzene derivative prevents oxidation and decomposition of solvent at the time of charging which causes decreased battery characteristics | UBE INDUSTRIES, LTD. (JP) | 2003-01-07 | — | — | US | claimed |