Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | TEK | Q02763 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9108122 | 0.89 | NQO1 (0.47) | RAB9ANPC1MAPTSMN1; SMN2CRHBP | |
| SCHEMBL22741638 | 0.85 | CYP1A2 (0.46) | RAB9ANPC1CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL22276545 | 0.85 | DHPS (0.42) | RAB9ANPC1CYP2A6MAPTALDH1A1 | |
| SCHEMBL23371163 | 0.85 | CYP1A2 (0.56) | RAB9ACYP1A2CYP2A6MAPTALDH1A1 | |
| SCHEMBL30092293 | 0.85 | CYP1A2 (0.56) | RAB9ACYP1A2CYP2A6MAPTALDH1A1 | |
| SCHEMBL22741696 | 0.84 | CYP1A2 (0.44) | RAB9ANPC1CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL22743384 | 0.83 | CYP1A1 (0.47) | RAB9ANPC1CYP1A2CYP2A6CYP1A1 | |
| SCHEMBL28588853 | 0.83 | HDAC4 (0.58) | RAB9ANPC1CYP1A2CYP2A6MAPT | |
| SCHEMBL19084974 | 0.83 | CYP1A1 (0.56) | RAB9ANPC1CYP1A2CYP2A6MAPT | |
| SCHEMBL30184936 | 0.83 | NPC1 (0.45) | RAB9ANPC1MAPTSMN1; SMN2ALDH1A1 |
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-110446715-A | Organic compound, light-emitting component, light emitting device, electronic equipment, display device and lighting device | SEMICONDUCTOR ENERGY LAB | 2019-11-12 | — | — | CN | disclosed |