Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 7/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 4/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.38 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.38 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7593140 | 0.98 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAPOLBMAPT | |
| SCHEMBL7589344 | 0.94 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAAPOLBMAPT | |
| Hydrochloric Acid SCHEMBL7546118 | 0.93 | ALDH1A1 (0.46) | ALDH1A1KDM4EGAAPOLBMAPT | |
| SCHEMBL7596266 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4EGAAPOLBMAPT | |
| Hydrochloric Acid SCHEMBL5814418 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KDM4EGAAPOLBMAPT | |
| SCHEMBL29203833 | 0.84 | MAPT (0.45) | ALDH1A1KDM4EGAAMAPTRAB9A | |
| SCHEMBL2266611 | 0.84 | KCNH2 (0.40) | ALDH1A1KDM4EGAAPOLBMAPT | |
| SCHEMBL29606616 | 0.84 | KCNH2 (0.40) | ALDH1A1KDM4EGAAPOLBMAPT | |
| SCHEMBL29740108 | 0.83 | MAPT (0.53) | ALDH1A1KDM4EGAAMAPTRAB9A | |
| SCHEMBL374911 | 0.83 | MAPT (0.53) | ALDH1A1KDM4EGAAMAPTRAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0943661-B1 | Chromophoric compounds and their preparation process | SIEMENS AG (DE) | 2002-10-23 | — | — | EP | disclosed |
| US-6284889-B1 | E.G, 9-(N-(N-HEPTYL)-N-(2-HYDROXYETHYL)AMINO)BENZO(D)ISOTHIAZOLO(3, 3A, 4-AB)PHEN-7,12-OXAZINE 4-DIOXIDE. | SIEMENS AKTIENGESELLSCHAFT (DE) | 2001-09-04 | — | — | US | disclosed |
| EP-0943661-A2 | Chromophoric compounds and their preparation process | SIEMENS AKTIENGESELLSCHAFT (DE) | 1999-09-22 | — | — | EP | disclosed |