Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29391727 | 0.84 | ACHE (0.52) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL147931 | 0.84 | ACHE (0.52) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL8766625 | 0.82 | ACHE (0.50) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL134721 | 0.82 | ACHE (0.55) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL29692933 | 0.82 | ACHE (0.55) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL133412 | 0.82 | HSD17B1 (0.45) | HSD17B1HSD17B2PARP1CYP3A4CYP2C9 | |
| SCHEMBL9188288 | 0.81 | HSD17B1 (0.44) | HSD17B1HSD17B2PARP1CYP3A4CYP2C9 | |
| SCHEMBL9853340 | 0.81 | DHODH (0.45) | HSD17B1HSD17B2PARP1CYP3A4CYP2C9 | |
| SCHEMBL977663 | 0.80 | ACHE (0.58) | HSD17B1HSD17B2ACHESIGMAR1CYP3A4 | |
| SCHEMBL13538045 | 0.79 | ALDH1A1 (0.38) | ACHEMEN1KMT2ATDP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010069444-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2010-06-24 | — | — | WO | disclosed |
| WO-2010069442-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2010-06-24 | — | — | WO | disclosed |
| WO-2010006680-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES | MERCK PATENT GMBH (DE) | 2010-01-21 | — | — | WO | disclosed |