Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 4/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Triphenylene SCHEMBL28886902 | 1.00 | GPR3 (0.40) | GPR3HPRT1ALDH1A1HSD17B10CYP2A6 | |
| Triphenylene SCHEMBL28524195 | 1.00 | GPR3 (0.40) | GPR3HPRT1ALDH1A1HSD17B10CYP2A6 | |
| Dibenzothiophene SCHEMBL1003452 | 0.80 | GPR3 (0.74) | GPR3ALDH1A1TDP1CYP1A2HPGD | |
| Naphthalene SCHEMBL2367740 | 0.79 | CYP2A6 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| Naphthalene SCHEMBL15463693 | 0.79 | CYP2A6 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| Carbazole SCHEMBL7109722 | 0.78 | ALDH1A1 (0.70) | GPR3ALDH1A1HSD17B10CYP1A2HPGD | |
| Biphenyl SCHEMBL15656401 | 0.76 | ALDH1A1 (0.60) | ALDH1A1HSD17B10CYP2A6TDP1CYP1A2 | |
| Biphenyl SCHEMBL8068963 | 0.76 | ALDH1A1 (0.60) | ALDH1A1HSD17B10CYP2A6TDP1CYP1A2 | |
| Biphenyl SCHEMBL16872437 | 0.76 | ALDH1A1 (0.60) | ALDH1A1HSD17B10CYP2A6TDP1CYP1A2 | |
| SCHEMBL1006251 | 0.76 | HPRT1 (0.57) | GPR3HPRT1ALDH1A1HSD17B10CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115872980-A | Compound for organic photoelectric device, composition for organic photoelectric device, and display device | 三星SDI株式会社 | 2023-03-31 | — | — | CN | disclosed |