Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31722992 | 0.87 | ADORA2A (0.39) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5088679 | 0.86 | DRD2 (0.36) | CYP1A2PDE4APDE4CPDE4DCYP2A6 | |
| SCHEMBL6937631 | 0.85 | GPR84 (0.45) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL19959255 | 0.84 | CYP1A2 (0.43) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL15998741 | 0.84 | HTT (0.39) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL2656359 | 0.84 | NQO2 (0.43) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL30064989 | 0.84 | NQO2 (0.43) | ADORA2AADORA1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL17945537 | 0.82 | KMT2A (0.40) | KDM4EALDH1A1HSD17B10CYP1A2MEN1 | |
| SCHEMBL1408383 | 0.82 | TUBB4A (0.45) | KDM4EALDH1A1CYP1A2HPGDCYP2A6 | |
| SCHEMBL16540074 | 0.82 | NPC1 (0.34) | ADORA2AADORA1ALDH1A1CYP1A2CA1 |
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-107892702-A | Organic electroluminescent material and device | 环球展览公司 | 2018-04-10 | — | — | CN | disclosed |