Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27708412 | 1.00 | ALDH1A1 (0.42) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Anthracene SCHEMBL28182618 | 0.97 | ALDH1A1 (0.39) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Anthracene SCHEMBL28328637 | 0.95 | NQO2 (0.40) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL27695837 | 0.87 | ALDH1A1 (0.39) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Naphthalene SCHEMBL27496066 | 0.86 | CYP2A6 (0.50) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Naphthalene SCHEMBL8081934 | 0.86 | CYP2A6 (0.50) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Naphthalene SCHEMBL28076935 | 0.83 | CYP2A6 (0.47) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| Acridine SCHEMBL27575353 | 0.81 | ALDH1A1 (0.65) | ALDH1A1TDP1HPGDMAPTGLA | |
| Anthracene SCHEMBL28582060 | 0.76 | CYP2A6 (0.50) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 | |
| SCHEMBL3798534 | 0.76 | ALDH1A1 (0.61) | ALDH1A1HSD17B10CYP3A4HIF1ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104364925-A | Synthesis of aza-acenes as novel N-type materials for organic electronics | UNIV SOUTHERN CALIFORNIA | 2015-02-18 | — | — | CN | claimed |
| CN-104364925-A | Synthesis of aza-acenes as novel N-type materials for organic electronics | UNIV SOUTHERN CALIFORNIA | 2015-02-18 | — | — | CN | disclosed |