Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.62 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.62 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.45 |
| ▸ | FYN | P06241 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | AHR | P35869 | 2/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL31007093 | 0.92 | ALDH1A1 (0.54) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL28163902 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL20735843 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL29368234 | 0.81 | HTR2A (0.54) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL1264430 | 0.81 | HTR2A (0.54) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL9343680 | 0.81 | HPRT1 (0.70) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL4849253 | 0.79 | ALDH1A1 (0.80) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL4854152 | 0.79 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL4852455 | 0.79 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL4852029 | 0.79 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9947879-B2 | Anthracene derivative and organic electroluminescence element using same | IDEMITSU KOSAN CO., LTD. (JP) | 2018-04-17 | — | — | US | disclosed |