Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL9264239 | 0.88 | CA2 (0.49) | CA2ALDH1A1SMN1; SMN2MAPTRAB9A | |
| Tetrabuthylammonium SCHEMBL11739846 | 0.88 | KCNH2 (0.44) | CA2ALDH1A1SMN1; SMN2MAPTNPC1 | |
| Tetrabuthylammonium SCHEMBL29130242 | 0.84 | HSD17B3 (0.50) | ALDH1A1SMN1; SMN2LMNAHSD17B10KMT2A | |
| Tetrabuthylammonium SCHEMBL29130246 | 0.83 | HSD17B3 (0.49) | ALDH1A1SMN1; SMN2LMNAHSD17B10 | |
| Tetrabuthylammonium SCHEMBL157621 | 0.82 | CYP2C9 (0.47) | ALDH1A1SMN1; SMN2MAPTLMNAS1PR3 | |
| SCHEMBL7646230 | 0.81 | ALDH1A1 (0.58) | CA2ALDH1A1SMN1; SMN2MAPTNPC1 | |
| SCHEMBL601340 | 0.81 | ALDH1A1 (0.58) | CA2ALDH1A1SMN1; SMN2MAPTNPC1 | |
| Tetrabuthylammonium SCHEMBL12490326 | 0.81 | TSHR (0.60) | CA2ALDH1A1SMN1; SMN2MAPTNPC1 | |
| Tetrabuthylammonium SCHEMBL9463322 | 0.81 | CYP2C9 (0.46) | ALDH1A1SMN1; SMN2MAPTLMNAS1PR3 | |
| Tetrabuthylammonium SCHEMBL5693991 | 0.81 | KCNH2 (0.49) | CA2ALDH1A1SMN1; SMN2LMNAS1PR3 |
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-4063889-A | Halosolvent dyeing process for polyester with cationic dyes having sulfosuccinate anions | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-12-20 | — | — | US | disclosed |