Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | NCF1 | P14598 | 1/20 | 0.52 |
| ▸ | NQO1 | P15559 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14436669 | 0.82 | CYP1A2 (0.32) | CYP1A2CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL3261919 | 0.80 | CA1 (0.58) | KDM4EALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL443070 | 0.79 | CYP1A2 (0.79) | CYP1A2CYP2A6NCF1NQO1KDM4E | |
| SCHEMBL29447161 | 0.79 | CYP1A2 (0.79) | CYP1A2CYP2A6NCF1NQO1KDM4E | |
| SCHEMBL1004417 | 0.77 | CYP1A2 (0.83) | CYP1A2CYP2A6KDM4EALDH1A1MEN1 | |
| SCHEMBL8402770 | 0.77 | CYP1A2 (0.56) | CYP1A2CYP2A6NCF1KDM4EALDH1A1 | |
| SCHEMBL7007855 | 0.77 | ACHE (0.50) | ALDH1A1NPC1LMNARAB9A | |
| SCHEMBL7456084 | 0.74 | CYP1A2 (0.71) | CYP1A2CYP2A6NCF1NQO1KDM4E | |
| SCHEMBL6891918 | 0.74 | CYP1A2 (0.71) | CYP1A2CYP2A6NCF1NQO1KDM4E | |
| SCHEMBL2249185 | 0.74 | CYP1A2 (0.71) | CYP1A2CYP2A6NCF1NQO1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3800180-A1 | ORGANIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT, DISPLAY APPARATUS, IMAGE PICKUP APPARATUS, LIGHTING APPARATUS, AND MOVING OBJECT | CANON KABUSHIKI KAISHA (JP) | 2021-04-07 | — | — | EP | disclosed |