Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL17264178 | 0.85 | CYP1A2 (0.58) | SRD5A2RAB9ANPC1CYP1A2CYP2D6 | |
| SCHEMBL17904143 | 0.80 | CYP1A2 (0.54) | SRD5A2RAB9ANPC1CYP1A2CYP2D6 | |
| SCHEMBL13475665 | 0.76 | SRD5A1 (0.42) | SRD5A1SRD5A2RAB9ANPC1CYP1A2 | |
| SCHEMBL19049725 | 0.74 | RXRA (0.39) | HSD17B10ADRA2ADRD2ADRA2BADRA2C | |
| SCHEMBL4818156 | 0.74 | CES1 (0.56) | SRD5A1SRD5A2RAB9ANPC1CES1 | |
| SCHEMBL6853221 | 0.74 | SRD5A1 (0.52) | SRD5A1SRD5A2RAB9ANPC1HSD17B10 | |
| Dihydrophenanthrene SCHEMBL155991 | 0.73 | CES1 (0.68) | SRD5A1SRD5A2RAB9ANPC1CES1 | |
| Dihydrophenanthrene SCHEMBL30297028 | 0.73 | CES1 (0.68) | SRD5A1SRD5A2RAB9ANPC1CES1 | |
| Dihydrophenanthrene SCHEMBL29404495 | 0.73 | CES1 (0.68) | SRD5A1SRD5A2RAB9ANPC1CES1 | |
| SCHEMBL1639476 | 0.73 | CYP1A2 (0.58) | SRD5A2RAB9ANPC1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010068000-A2 | ARYL AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | 주식회사 두산 (KR) | 2010-06-17 | — | — | WO | disclosed |