Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.59 |
| ▸ | KIF11 | P52732 | 9/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.50 |
| ▸ | GPR3 | P46089 | 1/20 | 0.50 |
| ▸ | TOP2A | P11388 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15821307 | 0.96 | AHR (0.63) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL17864133 | 0.93 | AHR (0.64) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL31520457 | 0.89 | AHR (0.59) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL15821417 | 0.89 | AHR (0.69) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL24275420 | 0.84 | AHR (0.57) | AHRKIF11ALDH1A1HSD17B10GPR3 | |
| Carbazole SCHEMBL28203975 | 0.83 | ALDH1A1 (0.64) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL31450262 | 0.83 | KIF11 (0.56) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| Phenanthrene SCHEMBL27734321 | 0.82 | ALDH1A1 (0.74) | AHRKIF11ALDH1A1HSD17B10HIF1A | |
| SCHEMBL21888145 | 0.81 | AHR (0.58) | AHRKIF11ALDH1A1HSD17B10HPRT1 | |
| SCHEMBL20049058 | 0.81 | AHR (0.68) | AHRKIF11ALDH1A1HSD17B10GPR3 |
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-2016099037-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-23 | — | — | WO | disclosed |