Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.59 |
| ▸ | ESR1 | P03372 | 5/20 | 0.59 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27827305 | 0.83 | CASR (0.43) | ESR2ESR1ARCYP1A2MAPT | |
| SCHEMBL31038135 | 0.82 | AR (0.56) | ARCYP1A2MAPTTP53BLM | |
| SCHEMBL1043086 | 0.82 | AR (0.56) | ARCYP1A2MAPTTP53BLM | |
| SCHEMBL14533816 | 0.81 | AR (0.61) | ESR2ESR1ARCYP1A2MAPT | |
| SCHEMBL27647449 | 0.80 | AR (0.55) | ARCYP1A2MAPTTP53BLM | |
| SCHEMBL19640290 | 0.80 | AR (0.55) | ARCYP1A2MAPTTP53BLM | |
| SCHEMBL31038193 | 0.80 | CYP1A2 (0.46) | ESR2ESR1CYP1A2MAPTGAA | |
| SCHEMBL26613488 | 0.79 | ESR1 (0.79) | ESR2ESR1ARCYP1A2MEN1 | |
| SCHEMBL31095778 | 0.79 | LCK (0.49) | ARCYP1A2MAPTMEN1LMNA | |
| SCHEMBL16586109 | 0.77 | ESR1 (0.77) | ESR2ESR1ARCYP1A2MEN1 |
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-2504419-B1 | DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU | HENKEL AG & CO KGAA (DE) | 2017-02-01 | — | — | EP | disclosed |
| EP-2504419-A1 | DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU | Henkel AG & Co. KGaA (DE) | 2012-10-03 | — | — | EP | disclosed |
| WO-2011064158-A1 | DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU | HENKEL AG & CO. KGAA (DE) | 2011-06-03 | — | — | WO | disclosed |