Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | FYN | P06241 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | AHR | P35869 | 2/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31494528 | 0.84 | ALDH1A1 (0.56) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL4851809 | 0.82 | CYP1A2 (0.45) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL4851519 | 0.79 | CYP1A2 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL21625683 | 0.75 | TSHR (0.42) | CYP1A2ALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL4852113 | 0.75 | ALDH1A1 (0.43) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL4851957 | 0.74 | ALDH1A1 (0.54) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL26028 | 0.73 | CYP1A2 (0.47) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL29562021 | 0.73 | CYP1A2 (0.47) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL597744 | 0.72 | CYP1A2 (0.71) | CYP1A2ALDH1A1HSD17B10HPGDFYN | |
| SCHEMBL1232448 | 0.72 | CYP1A2 (0.71) | CYP1A2ALDH1A1HSD17B10HPGDFYN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3100005-A | — | — | None | — | — | JP | disclosed |
| JP-H03100005-A | PREPARATION OF CONDENSED RING COMPOUND POLYMER | IDEMITSU KOSAN CO LTD | 1991-04-25 | — | — | JP | disclosed |